Exact Mass: 106.069

Exact Mass Matches: 106.069

Found 56 metabolites which its exact mass value is equals to given mass value 106.069, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

o-Xylene

1,2-Dimethylbenzene

C8H10 (106.0782)


1,2-dimethylbenzene, also known as 2-xylene or ortho-xylene, is a member of the class of compounds known as O-xylenes. O-xylenes are aromatic compounds that contain a o-xylene moiety, which is a monocyclic benzene carrying exactly two methyl groups at the 1- and 2-positions. 1,2-dimethylbenzene is a geranium tasting compound found in black walnut and papaya, which makes 1,2-dimethylbenzene a potential biomarker for the consumption of these food products. 1,2-dimethylbenzene can be found primarily in blood, feces, and saliva. 1,2-dimethylbenzene exists in all eukaryotes, ranging from yeast to humans. 1,2-dimethylbenzene is formally rated as an unfounded non-carcinogenic (IARC 3) potentially toxic compound. o-Xylene (ortho-xylene) is an aromatic hydrocarbon with the formula C6H4(CH3)2. with two methyl substituents bonded to adjacent carbon atoms of a benzene ring (the ortho configuration). It is a constitutional isomer of m-xylene and p-xylene, the mixture being called xylene or xylenes. o-Xylene is a colorless slightly oily flammable liquid . If the compound has been ingested, rapid gastric lavage should be performed using 5\\% sodium bicarbonate. For skin contact, the skin should be washed with soap and water. If the compound has entered the eyes, they should be washed with large quantities of isotonic saline or water. In serious cases, atropine and/or pralidoxime should be administered. Anti-cholinergic drugs work to counteract the effects of excess acetylcholine and reactivate AChE. Atropine can be used as an antidote in conjunction with pralidoxime or other pyridinium oximes (such as trimedoxime or obidoxime), though the use of -oximes has been found to be of no benefit, or possibly harmful, in at least two meta-analyses. Atropine is a muscarinic antagonist, and thus blocks the action of acetylcholine peripherally (T3DB). o-Xylene belongs to the family of Toluenes. These are compounds containing a benzene ring which bears a methane group.

   

p-Xylene

1,4-Dimethylbenzene

C8H10 (106.0782)


P-xylene, also known as para-xylene or 1,4-dimethylbenzene, is a member of the class of compounds known as P-xylenes. P-xylenes are aromatic compounds that contain a p-xylene moiety, which is a monocyclic benzene carrying exactly two methyl groups at the 1- and 4-positions. P-xylene can be found in a number of food items such as black walnut, yellow bell pepper, green bell pepper, and parsley, which makes P-xylene a potential biomarker for the consumption of these food products. P-xylene can be found primarily in feces and saliva. P-xylene is formally rated as an unfounded non-carcinogenic (IARC 3) potentially toxic compound. p-Xylene (para-xylene) is an aromatic hydrocarbon. It is one of the three isomers of dimethylbenzene known collectively as xylenes. The p- stands for para-, indicating that the two methyl groups in p-xylene occupy the diametrically opposite substituent positions 1 and 4. It is in the positions of the two methyl groups, their arene substitution pattern, that it differs from the other isomers, o-xylene and m-xylene. All have the same chemical formula C6H4(CH3)2. All xylene isomers are colorless and highly flammable. The odor threshold of p-xylene is 0.62 parts per million (ppm) . If the compound has been ingested, rapid gastric lavage should be performed using 5\\% sodium bicarbonate. For skin contact, the skin should be washed with soap and water. If the compound has entered the eyes, they should be washed with large quantities of isotonic saline or water. In serious cases, atropine and/or pralidoxime should be administered. Anti-cholinergic drugs work to counteract the effects of excess acetylcholine and reactivate AChE. Atropine can be used as an antidote in conjunction with pralidoxime or other pyridinium oximes (such as trimedoxime or obidoxime), though the use of -oximes has been found to be of no benefit, or possibly harmful, in at least two meta-analyses. Atropine is a muscarinic antagonist, and thus blocks the action of acetylcholine peripherally (T3DB). p-Xylene is an aromatic hydrocarbon based on benzene with two methyl substituents with the chemical formula C8H10 or C6H4(CH3)2. The “p” stands for para, identifying the location of the methyl groups as across from one another. (Wikipedia)

   

Ethylbenzene

alpha-Methyltoluene

C8H10 (106.0782)


Ethyl benzene, also known as ethylbenzol or alpha-methyltoluene, belongs to benzene and substituted derivatives class of compounds. Those are aromatic compounds containing one monocyclic ring system consisting of benzene. Ethyl benzene can be found in black walnut and safflower, which makes ethyl benzene a potential biomarker for the consumption of these food products. Ethyl benzene can be found primarily in blood and feces. Ethyl benzene exists in all eukaryotes, ranging from yeast to humans. Ethyl benzene is formally rated as possibly a carcinogenic (IARC 2B) potentially toxic compound. Ethyl benzene is an organic compound with the formula C6H5CH2CH3. It is a highly flammable, colorless liquid with an odor similar to that of gasoline. This monocyclic aromatic hydrocarbon is important in the petrochemical industry as an intermediate in the production of styrene, the precursor to polystyrene, a common plastic material. In 2012, more than 99\\% of ethylbenzene produced was consumed in the production of styrene. Ethyl benzene is also used to make other chemicals, in fuel, and as a solvent in inks, rubber adhesives, varnishes, and paints. Ethyl benzene exposure can be determined by testing for the breakdown products in urine . Following oral exposure, a gastric lavage is recommended. Protect airway by placement in Trendelenburg and left lateral decubitus position or by endotracheal intubation. Control any seizures first. Following inhalation, move patient to fresh air. Monitor for respiratory distress. If cough or difficulty breathing develops, evaluate for respiratory tract irritation, bronchitis, or pneumonitis. Administer oxygen and assist ventilation as required. Following eye exposure, irrigate exposed eyes with copious amounts of room temperature water for at least 15 minutes. In case of dermal exposure, remove contaminated clothing and wash exposed area thoroughly with soap and water. Treat dermal irritation or burns with standard topical therapy. Patients developing dermal hypersensitivity reactions may require treatment with systemic or topical corticosteroids or antihistamines. Some chemicals can produce systemic poisoning by absorption through intact skin. Carefully observe patients with dermal exposure for the development of any systemic signs or symptoms and administer symptomatic treatment as necessary (T36) (T3DB). Ethylbenzene belongs to the family of Substituted Benzenes. These are aromatic compounds containing a benzene substituted at one or more positions.

   

m-Xylene

1,3-Dimethylbenzene

C8H10 (106.0782)


M-xylene, also known as 1,3-dimethylbenzene or M-xylol, is a member of the class of compounds known as M-xylenes. M-xylenes are aromatic compounds that contain a m-xylene moiety, which is a monocyclic benzene carrying exactly two methyl groups at the 1- and 3-positions. M-xylene is a plastic tasting compound found in black walnut, parsley, and safflower, which makes M-xylene a potential biomarker for the consumption of these food products. M-xylene can be found primarily in blood and feces. M-xylene exists in all eukaryotes, ranging from yeast to humans. M-xylene is formally rated as an unfounded non-carcinogenic (IARC 3) potentially toxic compound. m-Xylene (meta-xylene) is an aromatic hydrocarbon. It is one of the three isomers of dimethylbenzene known collectively as xylenes. The m- stands for meta-, indicating that the two methyl groups in m-xylene occupy positions 1 and 3 on a benzene ring. It is in the positions of the two methyl groups, their arene substitution pattern, that it differs from the other isomers, o-xylene and p-xylene. All have the same chemical formula C6H4(CH3)2. All xylene isomers are colorless and highly flammable . If the compound has been ingested, rapid gastric lavage should be performed using 5\\% sodium bicarbonate. For skin contact, the skin should be washed with soap and water. If the compound has entered the eyes, they should be washed with large quantities of isotonic saline or water. In serious cases, atropine and/or pralidoxime should be administered. Anti-cholinergic drugs work to counteract the effects of excess acetylcholine and reactivate AChE. Atropine can be used as an antidote in conjunction with pralidoxime or other pyridinium oximes (such as trimedoxime or obidoxime), though the use of -oximes has been found to be of no benefit, or possibly harmful, in at least two meta-analyses. Atropine is a muscarinic antagonist, and thus blocks the action of acetylcholine peripherally (T3DB). m-Xylene, also known as 1,3-xylene or m-dimethylbenzene, belongs to the class of organic compounds known as m-xylenes. These are aromatic compounds that contain a m-xylene moiety, which is a monocyclic benzene carrying exactly two methyl groups at the 1- and 3-positions. The conversion m-xylene to isophthalic acid entails catalytic oxidation. m-Xylene (meta-xylene) is an aromatic hydrocarbon. m-Xylene is possibly neutral. m-Xylene is a plastic tasting compound. m-xylene is found, on average, in the highest concentration in safflowers. m-xylene has also been detected, but not quantified, in black walnuts and parsley. This could make m-xylene a potential biomarker for the consumption of these foods. Xylenes are not acutely toxic, for example the LD50 (rat, oral) is 4300 mg/kg. m-Xylene is a potentially toxic compound. Concerns with xylenes focus on narcotic effects. The m- stands for meta-, indicating that the two methyl groups in m-xylene occupy positions 1 and 3 on a benzene ring. All xylene isomers are colorless and highly flammable. Petroleum contains about 1 weight percent xylenes.

   

DI(Hydroxyethyl)ether

beta,Beta-dihydroxydiethyl ether

C4H10O3 (106.063)


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(2R*,3R*)-1,2,3-Butanetriol

(2R*,3R*)-1,2,3-Butanetriol

C4H10O3 (106.063)


Constituent of the fruit of Foeniculum vulgare (fennel). (2R*,3R*)-1,2,3-Butanetriol is found in herbs and spices. 1-Deoxy-L-erythritol is a constituent of the fruit of Carum ajowan (ajowan).

   

Trihydroxybutane

butane-1,1,1-triol

C4H10O3 (106.063)


Trihydroxybutane belongs to the class of organic compounds known as polyols. These are organic compounds containing more than one hydroxyl groups.

   

ether

InChI=1\C8H10\c1-2-8-6-4-3-5-7-8\h3-7H,2H2,1H

C8H10 (106.0782)


   

1,2,4-BUTANETRIOL

1,2,4-BUTANETRIOL

C4H10O3 (106.063)


A triol that is butane carrying three hydroxy substituents at position 1, 2 and 4.

   

2-methoxypropane-1,3-diol

2-methoxypropane-1,3-diol

C4H10O3 (106.063)


   

UNII:4G03VY2NKP

3-Methoxy-1,2-propanediol

C4H10O3 (106.063)


   

Diethyl ether peroxide

Diethyl ether peroxide

C4H10O3 (106.063)


   

butane-1,2,3-triol

(2R*,3R*)-1,2,3-Butanetriol

C4H10O3 (106.063)


   

1,1-difluorocyclopentane

1,1-difluorocyclopentane

C5H8F2 (106.0594)


   

Trimethoxymethane

Trimethyl orthoformate

C4H10O3 (106.063)


   

1,7-OCTADIYNE

1,7-OCTADIYNE

C8H10 (106.0782)


   

6,6-Dimethylfulvene

6,6-Dimethylfulvene

C8H10 (106.0782)


   

2,2-Dimethoxyethanol

2,2-Dimethoxyethanol

C4H10O3 (106.063)


   

2-(Hydroxymethyl)-1,3-propanediol

2-(Hydroxymethyl)-1,3-propanediol

C4H10O3 (106.063)


   

1-ethynylcyclohexene

1-ethynylcyclohexene

C8H10 (106.0782)


   

2,6-Octadiyne

2,6-Octadiyne

C8H10 (106.0782)


   

2-DEOXYERYTHRITOL

(S)-1,2,4-Butanetriol

C4H10O3 (106.063)


   

2,2-dideuterioethenylbenzene

2,2-dideuterioethenylbenzene

C8H6D2 (106.0752)


   

3,5-Octadiyne

3,5-Octadiyne

C8H10 (106.0782)


   

1,4-Dimethylbenzene-13C8

1,4-Dimethylbenzene-13C8

C8H10 (106.0782)


   

1,2-di(methyl)benzene

1,2-di(methyl)benzene

C8H10 (106.0782)


   

1,2,4-BUTANETRIOL

1,2,4-BUTANETRIOL

C4H10O3 (106.063)


   

1,3-di(methyl)benzene

1,3-di(methyl)benzene

C8H10 (106.0782)


   

1,4-Dimethyl-13C2-benzene

1,4-Dimethyl-13C2-benzene

C8H10 (106.0782)


   

methoxy(methoxymethoxy)methane

methoxy(methoxymethoxy)methane

C4H10O3 (106.063)


   

lithium acetylacetonate

lithium acetylacetonate

C5H7LiO2 (106.0606)


   

Bicyclo[2.2.1]hept-2-ene,5-methylene-

Bicyclo[2.2.1]hept-2-ene,5-methylene-

C8H10 (106.0782)


   

3-amino-2-oxazolidinone d4

3-amino-2-oxazolidinone d4

C3H2D4N2O2 (106.068)


   

(Fluoromethyl)trimethylsilane

(Fluoromethyl)trimethylsilane

C4H11FSi (106.0614)


   

Lithium (2Z)-4-oxo-2-penten-2-olate

Lithium (2Z)-4-oxo-2-penten-2-olate

C5H7LiO2 (106.0606)


   

Xylene

Dimethyl benzene

C8H10 (106.0782)


Xylene is a mixture of three structural isomers of the aromatic hydrocarbon dimethylbenzene:1,2-Dimethylbenzene, 1,3-Dimethylbenzene and 1,4-Dimethylbenzene. Xylene is found in black walnut and corn.

   

1-Deoxy-l-erythritol

1-Deoxy-l-erythritol

C4H10O3 (106.063)


   

1-Deoxy-D-threitol

1-Deoxy-D-threitol

C4H10O3 (106.063)


   

1,3,5-Cyclooctatriene

1,3,5-Cyclooctatriene

C8H10 (106.0782)


   

1,3,6-Cyclooctatriene

1,3,6-Cyclooctatriene

C8H10 (106.0782)


   

O-Xylol

InChI=1\C8H10\c1-7-5-3-4-6-8(7)2\h3-6H,1-2H

C8H10 (106.0782)


   

m-Xylol

Xylene mixture (60\\% m-xylene, 9\\% o-xylene, 14\\% p-xylene, 17\\% ethylbenzene)

C8H10 (106.0782)


   

Chromar

InChI=1\C8H10\c1-7-3-5-8(2)6-4-7\h3-6H,1-2H

C8H10 (106.0782)


   

3-Methylthiopropylaminium

3-Methylthiopropylaminium

C4H12NS+ (106.069)


   

O-XYLENE

O-XYLENE

C8H10 (106.0782)


   

M-XYLENE

M-XYLENE

C8H10 (106.0782)


   

P-XYLENE

P-XYLENE

C8H10 (106.0782)


   

DIETHYLENE GLYCOL

1,5-Dihydroxy-3-oxapentane

C4H10O3 (106.063)


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1,2,3-Butanetriol

butane-1,2,3-triol

C4H10O3 (106.063)


   

Trihydroxybutane

Trihydroxybutane

C4H10O3 (106.063)


   

1-Deoxyerythritol

1-Deoxyerythritol

C4H10O3 (106.063)


   

Butanetriol

Butanetriol

C4H10O3 (106.063)


   

Deoxy-erythritol

Deoxy-erythritol

C4H10O3 (106.063)


   

(2r,3r)-butane-1,2,3-triol

(2r,3r)-butane-1,2,3-triol

C4H10O3 (106.063)


   

(2S)-3-methoxypropane-1,2-diol

71484-94-1; 1,2-Propanediol, 3-methoxy-, (S)-; ZINC01866958

C4H10O3 (106.063)


{"Ingredient_id": "HBIN006619","Ingredient_name": "(2S)-3-methoxypropane-1,2-diol","Alias": "71484-94-1; 1,2-Propanediol, 3-methoxy-, (S)-; ZINC01866958","Ingredient_formula": "C4H10O3","Ingredient_Smile": "COCC(CO)O","Ingredient_weight": "106.12","OB_score": "40.52005256","CAS_id": "71484-94-1","SymMap_id": "SMIT13944","TCMID_id": "NA","TCMSP_id": "MOL013266","TCM_ID_id": "NA","PubChem_id": "156179","DrugBank_id": "NA"}

   

(2s,3r)-butane-1,2,3-triol

(2s,3r)-butane-1,2,3-triol

C4H10O3 (106.063)