Exact Mass: 161.914585

Exact Mass Matches: 161.914585

Found 67 metabolites which its exact mass value is equals to given mass value 161.914585, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

2,4-Dichlorophenol

2,4-Dichlorophenol, 14C-labeled CPD

C6H4Cl2O (161.9639194)


CONFIDENCE standard compound; INTERNAL_ID 797; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 13281; ORIGINAL_PRECURSOR_SCAN_NO 13277 CONFIDENCE standard compound; INTERNAL_ID 797; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 13308; ORIGINAL_PRECURSOR_SCAN_NO 13303 CONFIDENCE standard compound; INTERNAL_ID 797; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 13388; ORIGINAL_PRECURSOR_SCAN_NO 13386 CONFIDENCE standard compound; INTERNAL_ID 797; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 13208; ORIGINAL_PRECURSOR_SCAN_NO 13205 CONFIDENCE standard compound; INTERNAL_ID 797; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 13179; ORIGINAL_PRECURSOR_SCAN_NO 13176 CONFIDENCE standard compound; INTERNAL_ID 797; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4788; ORIGINAL_PRECURSOR_SCAN_NO 4787 CONFIDENCE standard compound; INTERNAL_ID 797; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4687; ORIGINAL_PRECURSOR_SCAN_NO 4686 CONFIDENCE standard compound; INTERNAL_ID 797; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4701; ORIGINAL_PRECURSOR_SCAN_NO 4700 CONFIDENCE standard compound; INTERNAL_ID 797; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4705; ORIGINAL_PRECURSOR_SCAN_NO 4704 CONFIDENCE standard compound; INTERNAL_ID 797; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4715; ORIGINAL_PRECURSOR_SCAN_NO 4713 CONFIDENCE standard compound; INTERNAL_ID 797; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4673; ORIGINAL_PRECURSOR_SCAN_NO 4672 2,4-Dichlorophenol is a chlorinated organic chemical due to environmental exposure, that can be detected in breast milk. The free species of phenols and chlorinated organic appear to be most prevalent in milk. (PMID 16377264 ) [HMDB] 2,4-Dichlorophenol is a chlorinated organic chemical due to environmental exposure, that can be detected in breast milk. The free species of phenols and chlorinated organic appear to be most prevalent in milk. (PMID 16377264 ). D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000871 - Anthelmintics CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 8642

   

Trichloroacetic acid

Sanofi brand OF trichloroacetic acid

C2HCl3O2 (161.90421360000002)


Trichloroacetic acid (TCA; also known as trichloroethanoic acid) is an analogue of acetic acid in which the three hydrogen atoms of the methyl group have all been replaced by chlorine atoms. D009676 - Noxae > D002424 - Caustics Same as: D08633

   

Phosphoroselenoic acid

trihydroxy(selanylidene)-λ5-phosphane

H3O3PSe (161.89850280000002)


Phosphoroselenoic acid, H3SePO3, is the activated selenium donor compound required for the biosynthesis of selenocysteyl-tRNA, the precursor of specific selenocysteine residues in bacterial and mammalian selenoproteins. Phosphoroselenoic acid is also the selenium donor used to synthesize selenocysteine (Sec), the 21st amino acid, which is co-translationally incorporated into selenoproteins at in-frame UGA codons. A number of enzymes have selenocysteine residues and, in some cases, the residues are located at their active sites. Proteins containing selenocysteine have been described in all three domains of life (PMID: 18156471). Selenophosphate synthetase (EC 2.7.9.3, human SPS1, the product of the selD gene) produces monoselenophosphate from selenide and ATP. The SPS1-encoded enzyme depends on a selenium salvage system that recycles L-selenocysteine. Selenophosphate synthetase genes play a role in a cancer cells response to ionizing radiation and its reaction product, selenophosphate, might be involved in cancer prevention in a p53-dependent manner and could be applied to the development of a novel cancer therapy (PMID: 8986768, 10609888, 16786570). Phosphoroselenoic acid, H3SePO3, is the activated selenium donor compound required for the biosynthesis of selenocysteyl-tRNA, the precursor of specific selenocysteine residues in bacterial and mammalian selenoproteins. Selenocysteine is the 21st amino acid, because Sec has a specific tRNA and codon UGA, and shares a major stop codon UGA. A number of enzymes have selenocysteine, residues and in some cases at their active sites. Proteins containing the 21st amino acid, selenocysteine (Sec), have been described in all three domains of life. (PMID: 18156471) [HMDB] COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS

   

2,5-Dichlorophenol

2,5-Dichlorophenol, potassium salt

C6H4Cl2O (161.9639194)


CONFIDENCE standard compound; INTERNAL_ID 906; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 13208; ORIGINAL_PRECURSOR_SCAN_NO 13205 CONFIDENCE standard compound; INTERNAL_ID 906; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 13243; ORIGINAL_PRECURSOR_SCAN_NO 13239 CONFIDENCE standard compound; INTERNAL_ID 906; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 13287; ORIGINAL_PRECURSOR_SCAN_NO 13282 CONFIDENCE standard compound; INTERNAL_ID 906; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 13308; ORIGINAL_PRECURSOR_SCAN_NO 13303 CONFIDENCE standard compound; INTERNAL_ID 906; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 13281; ORIGINAL_PRECURSOR_SCAN_NO 13277 CONFIDENCE standard compound; INTERNAL_ID 906; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4965; ORIGINAL_PRECURSOR_SCAN_NO 4964 CONFIDENCE standard compound; INTERNAL_ID 906; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4975; ORIGINAL_PRECURSOR_SCAN_NO 4974 CONFIDENCE standard compound; INTERNAL_ID 906; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4984; ORIGINAL_PRECURSOR_SCAN_NO 4981 CONFIDENCE standard compound; INTERNAL_ID 906; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4995; ORIGINAL_PRECURSOR_SCAN_NO 4994 CONFIDENCE standard compound; INTERNAL_ID 906; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5002; ORIGINAL_PRECURSOR_SCAN_NO 5001 CONFIDENCE standard compound; INTERNAL_ID 906; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5041; ORIGINAL_PRECURSOR_SCAN_NO 5040 2,5-dichlorophenol belongs to the family of Phenols and Derivatives. These are compounds containing a phenol moiety, which is a benzene bearing an hydroxyl group.

   

2,6-DICHLOROPHENOL

2,6-DICHLOROPHENOL

C6H4Cl2O (161.9639194)


   

3,4-Dichlorophenol

3,4-DICHLOROPHENOL

C6H4Cl2O (161.9639194)


   

Tellurite

Tellurium oxide (teo2)

O2Te (161.896059)


Tellurite is a rare oxide mineral composed of tellurium dioxide (TeO2). It occurs as prismatic to acicular transparent yellow to white orthorhombic crystals. It occurs in the oxidation zone of mineral deposits containing tellurium minerals(Wikipedia). The tellurite ion is TeO32−. A tellurite (compound) is a compound that contains this ion.In slightly acid conditions, we have hydrogen tellurite ion, HTeO3−; with more acidic conditions we have tellurous acid, H2TeO3. Most tellurite compounds can be formed by heating the relevant oxide with tellurium dioxide, e.g., Na2O + TeO2 -> Na2TeO3. Potassium tellurite (K2TeO3) is used together with agar as part of a selective medium for growth of some bacteria (Clauberg medium). Tellurite is a rare oxide mineral composed of tellurium dioxide (TeO2). It occurs as prismatic to acicular transparent yellow to white orthorhombic crystals. It occurs in the oxidation zone of mineral deposits containing tellurium minerals(From Wiki)

   
   

2,3-Dichlorophenol

2,3-Dichlorophenol

C6H4Cl2O (161.9639194)


   

3,5-Dichlorophenol

3,5-Dichlorophenol

C6H4Cl2O (161.9639194)


   

IODINE MONOCHLORIDE

Iodine monochloride, 125I-labeled

ClI (161.87333)


   

Chloro 2,2-dichloroacetate

2,2-dichloroethanecarboperoxoyl chloride

C2HCl3O2 (161.90421360000002)


   

Disodium cyanodithioimidocarbamate

disodium [(cyanoimino)(sulfanidyl)methyl]sulfanide

C2N2Na2S2 (161.929832)


Antimicrobial agent used to control microorganisms in sugar cane and sugar beet mills

   

4-Vinyl-1,2,3-trithia-4-cyclohexene

4-Vinyl-1,2,3-trithia-4-cyclohexene

C5H6S3 (161.9631636)


   
   

2,4-DICHLOROPHENOL

2,4-DICHLOROPHENOL

C6H4Cl2O (161.9639194)


D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000871 - Anthelmintics

   

TRICHLOROACETIC ACID

TRICHLOROACETIC ACID

C2HCl3O2 (161.90421360000002)


D009676 - Noxae > D002424 - Caustics

   

barium carbide

barium carbide

C2Ba (161.905236)


   

Trifluorobromoethane

Trifluorobromoethane

C2H2BrF3 (161.9291948)


   

5-BROMOFURAN-2(5H)-ONE

5-BROMOFURAN-2(5H)-ONE

C4H3BrO2 (161.9316398)


   

Dichloro(chloromethyl)methylsilane

Dichloro(chloromethyl)methylsilane

C2H5Cl3Si (161.92261000000002)


   
   

4-chlorothiophene-2-carboxylic acid

4-chlorothiophene-2-carboxylic acid

C5H3ClO2S (161.9542288)


   

SODIUM 2-OXOMALONATE

SODIUM 2-OXOMALONATE

C3Na2O5 (161.954115)


   
   
   

5-Bromo-1H-1,2,4-triazol-3-amine

5-Bromo-1H-1,2,4-triazol-3-amine

C2H3BrN4 (161.95410579999998)


   

2-Chlorothiophene-3-carboxylic acid

2-Chlorothiophene-3-carboxylic acid

C5H3ClO2S (161.9542288)


   

4-Bromo-2(5h)-furanone

4-Bromo-2(5h)-furanone

C4H3BrO2 (161.9316398)


   

2,3-Dichlorophenol

2,3-Dichlorophenol

C6H4Cl2O (161.9639194)


   

2-Chloroethanesulfonyl chloride

2-Chloroethanesulfonyl chloride

C2H4Cl2O2S (161.9309064)


   

Sodium methanearsonate

Sodium methanearsonate

CH4AsNaO3 (161.9274094)


   

5-Chloro-2-thiophenecarboxylic acid

5-Chloro-2-thiophenecarboxylic acid

C5H3ClO2S (161.9542288)


   

aluminum silicate

aluminum silicate

Al2O5Si (161.914585)


   

sodium chromate

sodium chromate

CrNa2O4 (161.89971)


   

3,5-Dichlorophenol

3,5-Dichlorophenol

C6H4Cl2O (161.9639194)


   

3-Bromo-2(5H)-furanone

3-Bromo-2(5H)-furanone

C4H3BrO2 (161.9316398)


   

2-Propynoic acid,3-bromo-, methyl ester

2-Propynoic acid,3-bromo-, methyl ester

C4H3BrO2 (161.9316398)


   

3-Chlorothiophene-2-carboxylic acid

3-Chlorothiophene-2-carboxylic acid

C5H3ClO2S (161.9542288)


   
   

Poly(2,6-dimethyl-1,4-phenylene oxide)

Poly(2,6-dimethyl-1,4-phenylene oxide)

C6H4Cl2O (161.9639194)


   

2,5-Dimercapto-1,3,4-thiadiazole dilithium salt

2,5-Dimercapto-1,3,4-thiadiazole dilithium salt

C2N2S3.2Li (161.95437400000003)


   
   
   

2-Bromo-5-methyl-1,3,4-oxadiazole

2-Bromo-5-methyl-1,3,4-oxadiazole

C3H3BrN2O (161.94287279999998)


   

magnesium,dioxido(oxo)zirconium

magnesium,dioxido(oxo)zirconium

MgO3Zr (161.874503)


   

Ethyl dichlorophosphate

Ethyl dichlorophosphate

C2H5Cl2O2P (161.940422)


   

5-Chlorothiophene-3-carboxylic acid

5-Chlorothiophene-3-carboxylic acid

C5H3ClO2S (161.9542288)


   
   

Sodium Chromate Cr-51

Sodium Chromate Cr-51

CrNa2O4 (161.89971)


C1446 - Radiopharmaceutical Compound

   
   
   

Disodium cyanodithioimidocarbamate

disodium [(cyanoimino)(sulfanidyl)methyl]sulfanide

C2N2Na2S2 (161.929832)


Antimicrobial agent used to control microorganisms in sugar cane and sugar beet mills

   
   

Tetracyanonickelate ion

Tetracyanonickelate ion

C4N4Ni-2 (161.947643)


   

Tetracyano nickel

Tetracyano nickel

C4N4Ni-4 (161.947643)


   

Sulfinooxy hydrogen sulfite

Sulfinooxy hydrogen sulfite

H2O6S2 (161.92928320000001)


   

1,2,2-Trifluoroethene-1-sulfonic acid

1,2,2-Trifluoroethene-1-sulfonic acid

C2HF3O3S (161.9598512)


   

2,5-dichlorophenol

2,5-dichlorophenol

C6H4Cl2O (161.9639194)


A dichlorophenol with the chloro substituents at positions 2 and 5.

   

Trichloroacetate

TRICHLOROACETIC ACID

C2HCl3O2 (161.90421360000002)


A monocarboxylic acid that is acetic acid in which all three methyl hydrogens are substituted by chlorine. D009676 - Noxae > D002424 - Caustics Same as: D08633

   

Molybdate

Molybdate

MoO4 (161.885065)


A divalent inorganic anion obtained by removal of both protons from molybdic acid

   
   

3,4-DICHLOROPHENOL

3,4-DICHLOROPHENOL

C6H4Cl2O (161.9639194)


   
   

4-vinyl-1,2,3-trithio-5-cyclohexene

NA

C5H6S3 (161.9631636)


{"Ingredient_id": "HBIN010931","Ingredient_name": "4-vinyl-1,2,3-trithio-5-cyclohexene","Alias": "NA","Ingredient_formula": "C5H6S3","Ingredient_Smile": "C=CC1=CCSSS1","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "32207","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

2-(methyldisulfanyl)thiophene

2-(methyldisulfanyl)thiophene

C5H6S3 (161.9631636)