Exact Mass: 170.1181

Exact Mass Matches: 170.1181

Found 63 metabolites which its exact mass value is equals to given mass value 170.1181, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Aethusin

Aethusin; 2,8,10-Tridecatriene-4,6-diyne

C13H14 (170.1095)


A polyene that is tridecane carrying trans double bonds at positions 2, 8, and 10 and triple bonds at positions 4 and 6. It is a phytotoxin isolated from the plant, Aethusa cynapium.

   

Thiogeraniol

(2Z)-3,7-dimethylocta-2,6-diene-1-thiol

C10H18S (170.1129)


   

p-Menth-1-ene-8-thiol

alpha,alpha,4-Trimethyl-3-cyclohexene-1-methanethiol

C10H18S (170.1129)


p-Menth-1-ene-8-thiol is found in citrus. p-Menth-1-ene-8-thiol is a powerful flavour constituent of grapefruit juice detectable at 10 4 ppb (equiv. to 10 4 mg per ton of water Powerful flavour constituent of grapefruit juice detectable at 10?4 ppb (equiv. to 10?4 mg per ton of water). p-Menth-1-ene-8-thiol is found in citrus.

   

1,6,7-Trimethylnaphthalene

1,6,7-TRIMETHYLNAPHTHALENE

C13H14 (170.1095)


1,6,7-trimethylnaphthalene (CAS: 2245-38-7) with formula C10H5(CH3)3 is a solid and is insoluble in water. The molecular weight of 1,6,7-trimethylnaphthalene is 170.25. The melting point of 1,6,7-trimethylnaphthalene is 28C and the boiling point is 285C.

   

(+/-)-2,8-Epithio-cis-p-menthane

exo-(-)-4,7,7-Trimethyl-6-thiabicyclo(3.2.1)octane

C10H18S (170.1129)


(+/-)-2,8-Epithio-cis-p-menthane is used as a food additive [EAFUS] ("EAFUS: Everything Added to Food in the United States. [http://www.eafus.com/]")

   

2,3 or 10-Mercaptopinane

2,6,6-Trimethyl-bicyclo[3.1.1]heptane-2-thiol

C10H18S (170.1129)


2,3 or 10-Mercaptopinane is used as a food additive [EAFUS] ("EAFUS: Everything Added to Food in the United States. [http://www.eafus.com/]") It is used as a food additive .

   

Thiogeraniol

(2Z)-3,7-dimethylocta-2,6-diene-1-thiol

C10H18S (170.1129)


Thiogeraniol is a flavouring and perfumery ingredien Flavouring and perfumery ingredient

   

p-Menth-3-ene-3-thiol

5-Methyl-2-(1-methylethyl)cyclohexanethione, 9ci

C10H18S (170.1129)


p-Menth-3-ene-3-thiol is a flavouring ingredient. Flavouring ingredient

   

1,4,5-Trimethyl-naphtalene

1,4,5-Trimethylnaphthalene

C13H14 (170.1095)


1,4,5-Trimethyl-naphtalene belongs to the family of Naphthalenes. These are compounds containing a naphthalene moiety, which consists of two fused benzene rings.

   

1,6,7-TRIMETHYLNAPHTHALENE

1,6,7-TRIMETHYLNAPHTHALENE

C13H14 (170.1095)


   

1,2,5-Trimethylnaphthalene

1,2,5-Trimethylnaphthalene

C13H14 (170.1095)


   

1,3,7-TRIMETHYLNAPHTHALENE

1,3,7-TRIMETHYLNAPHTHALENE

C13H14 (170.1095)


   

2,3,6-TRIMETHYLNAPHTHALENE

2,3,6-TRIMETHYLNAPHTHALENE

C13H14 (170.1095)


   

2,8-epithio-cis-p-menthene

2,8-epithio-cis-p-menthene

C10H18S (170.1129)


   

1,2,6-Trimethylnaphthalene

1,2,6-Trimethylnaphthalene

C13H14 (170.1095)


   

1,3,6-TRIMETHYLNAPHTHALENE

1,3,6-TRIMETHYLNAPHTHALENE

C13H14 (170.1095)


   

1,4,6-TRIMETHYLNAPHTHALENE

1,4,6-TRIMETHYLNAPHTHALENE

C13H14 (170.1095)


   

2,8-Epithio-p-menthane

exo-(-)-4,7,7-Trimethyl-6-thiabicyclo(3.2.1)octane

C10H18S (170.1129)


   

2-Pinanethiol

2,6,6-Trimethyl-bicyclo[3.1.1]heptane-2-thiol

C10H18S (170.1129)


   

FEMA 3700

alpha,alpha,4-Trimethyl-3-cyclohexene-1-methanethiol

C10H18S (170.1129)


   

1,2,3,4-Tetrahydrofluorene

1,2,3,4-Tetrahydrofluorene

C13H14 (170.1095)


   

6-Methyl-1,2,3,5-tetrahydro-s-indacene

6-Methyl-1,2,3,5-tetrahydro-s-indacene

C13H14 (170.1095)


   

1,2,4-Trimethylnaphthalene

1,2,4-Trimethylnaphthalene

C13H14 (170.1095)


   

Isothiocineole

Isothiocineole

C10H18S (170.1129)


   

3-TRIETHYLSILYL-2-PROPYN-1-OL

3-TRIETHYLSILYL-2-PROPYN-1-OL

C9H18OSi (170.1127)


   

4-acetylpiperazine-1-carboximidamide

4-acetylpiperazine-1-carboximidamide

C7H14N4O (170.1168)


   

1,3,8-Trimethylnaphthalene

1,3,8-Trimethylnaphthalene

C13H14 (170.1095)


   

4-Oxo-2,2,6,6-tetramethylpiperidinooxy

4-Oxo-2,2,6,6-tetramethylpiperidinooxy

C9H16NO2 (170.1181)


   

4,6,8-Trimethylazulene

Azulene,4,6,8-trimethyl-

C13H14 (170.1095)


A member of the class of azulenes that is azulene substituted by methyl groups at positions 4, 6 and 8 respectively.

   

Dicyclopentylphosphine

Dicyclopentylphosphine

C10H19P (170.1224)


   

1-ETHYNYLCYCLOPENTYLBENZENE

1-ETHYNYLCYCLOPENTYLBENZENE

C13H14 (170.1095)


   

3-TERT-BUTYLDIMETHYLSILYL-2-PROPYN-1-OL

3-TERT-BUTYLDIMETHYLSILYL-2-PROPYN-1-OL

C9H18OSi (170.1127)


   

tert-butyl-dimethyl-prop-2-ynoxysilane

tert-butyl-dimethyl-prop-2-ynoxysilane

C9H18OSi (170.1127)


   

D-Phenyl-D5-Alanine

D-Phenyl-D5-Alanine

C9H6D5NO2 (170.1104)


   

5-Norbornene-2-phenyl

5-Norbornene-2-phenyl

C13H14 (170.1095)


   

(1S,4S,5S)-4,7,7-Trimethyl-6-thiabicyclo[3.2.1]octane

(1S,4S,5S)-4,7,7-Trimethyl-6-thiabicyclo[3.2.1]octane

C10H18S (170.1129)


   

L-Phenylalanine-d5

L-Phenylalanine-d5

C9H6D5NO2 (170.1104)


   

Naphthalene,2,3,6-trimethyl-

Naphthalene,2,3,6-trimethyl-

C13H14 (170.1095)


   

Magnesium bis(2-methyl-2-propanolate)

Magnesium bis(2-methyl-2-propanolate)

C8H18MgO2 (170.1157)


   

1-Propylnaphthalene

1-Propylnaphthalene

C13H14 (170.1095)


   

2-Isopropylnaphthalene

2-Isopropylnaphthalene

C13H14 (170.1095)


   

cyanopropyl dimethyl dimethylamino silane

cyanopropyl dimethyl dimethylamino silane

C8H18N2Si (170.1239)


   

2-Propylnaphthalene

2-Propylnaphthalene

C13H14 (170.1095)


   

Naphthalene,1-(1-methylethyl)-

Naphthalene,1-(1-methylethyl)-

C13H14 (170.1095)


   

1-(trimethylsilyloxy)-cyclohex-1-ene

1-(trimethylsilyloxy)-cyclohex-1-ene

C9H18OSi (170.1127)


   

1-buten-1-yl methyl sulfide

1-buten-1-yl methyl sulfide

C10H18S (170.1129)


1-(Methylthio)-1-butene is a flavouring ingredient. It is found in roasted peanuts.

   

2-N-(2,2,3,3-tetradeuteriocyclopropyl)-1,3,5-triazine-2,4,6-triamine

2-N-(2,2,3,3-tetradeuteriocyclopropyl)-1,3,5-triazine-2,4,6-triamine

C6H6D4N6 (170.1218)


   

1,2,3-trimethylnaphthalene

1,2,3-trimethylnaphthalene

C13H14 (170.1095)


   

5-Methyl-2-(1-methylethyl)cyclohexanethione

5-Methyl-2-(1-methylethyl)cyclohexanethione

C10H18S (170.1129)


   

Cyclopentene, 3-methyl-1-(trimethylsilyloxy)-

Cyclopentene, 3-methyl-1-(trimethylsilyloxy)-

C9H18OSi (170.1127)


   

2-Trimethylsiloxy-4-methyl-1,3-pentadiene

2-Trimethylsiloxy-4-methyl-1,3-pentadiene

C9H18OSi (170.1127)


   

(2-Cyclohexen-1-yloxy)(trimethyl)silane

(2-Cyclohexen-1-yloxy)(trimethyl)silane

C9H18OSi (170.1127)


   

AI3-28792

Naphthalene, 1,6,7-trimethyl- (8CI)(9CI)

C13H14 (170.1095)


   
   

1,5-Hexadien-3-ol, TMS derivative

1,5-Hexadien-3-ol, TMS derivative

C9H18OSi (170.1127)


   

Butyl(trimethylsilyl)ketene

Butyl(trimethylsilyl)ketene

C9H18OSi (170.1127)


   

1,4,5-Trimethylnaphthalene

1,4,5-Trimethylnaphthalene

C13H14 (170.1095)


   

p-Menthene-8-thiol

1-P-Menthene-8-thiol

C10H18S (170.1129)


   

3,3,6-trimethyl-2-thiabicyclo[2.2.2]octane

3,3,6-trimethyl-2-thiabicyclo[2.2.2]octane

C10H18S (170.1129)


   

2-ISOPROPYLNAPHTHALENE

SBB007801; 2027-17-0; 68442-08-0; BRN 1099059; Naphthalene, 2-(1-methylethyl)-; NSC166466; EINECS 217-976-0; NSC 166466; Naphthalene, isopropylated; 2-propan-2-ylnaphthalene; 4-05-00-01723 (Beilstein Handbook Reference); beta-Isopropylnaphthalene; 2-(1-Methylethyl)naphthalene; .beta.-Isopropylnaphthalene; HSDB 5863; Naphthalene, 2-isopropyl-; FR-0361; 2-iso-Propylnaphthalene

C13H14 (170.1095)


{"Ingredient_id": "HBIN005862","Ingredient_name": "2-ISOPROPYLNAPHTHALENE","Alias": "SBB007801; 2027-17-0; 68442-08-0; BRN 1099059; Naphthalene, 2-(1-methylethyl)-; NSC166466; EINECS 217-976-0; NSC 166466; Naphthalene, isopropylated; 2-propan-2-ylnaphthalene; 4-05-00-01723 (Beilstein Handbook Reference); beta-Isopropylnaphthalene; 2-(1-Methylethyl)naphthalene; .beta.-Isopropylnaphthalene; HSDB 5863; Naphthalene, 2-isopropyl-; FR-0361; 2-iso-Propylnaphthalene","Ingredient_formula": "C13H14","Ingredient_Smile": "CC(C)C1=CC2=CC=CC=C2C=C1","Ingredient_weight": "170.25 g/mol","OB_score": "31.8537084","CAS_id": "68442-08-0","SymMap_id": "SMIT09993","TCMID_id": "NA","TCMSP_id": "MOL008768","TCM_ID_id": "NA","PubChem_id": "16238","DrugBank_id": "NA"}

   

trideca-2,8,10-trien-4,6-diyne

trideca-2,8,10-trien-4,6-diyne

C13H14 (170.1095)


   

(1s,4r,6r)-3,3,6-trimethyl-2-thiabicyclo[2.2.2]octane

(1s,4r,6r)-3,3,6-trimethyl-2-thiabicyclo[2.2.2]octane

C10H18S (170.1129)


   

1-ethyl-2-methylnaphthalene

1-ethyl-2-methylnaphthalene

C13H14 (170.1095)