Exact Mass: 161.9598512

Exact Mass Matches: 161.9598512

Found 38 metabolites which its exact mass value is equals to given mass value 161.9598512, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 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

   

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)


   

2,3-Dichlorophenol

2,3-Dichlorophenol

C6H4Cl2O (161.9639194)


   

3,5-Dichlorophenol

3,5-Dichlorophenol

C6H4Cl2O (161.9639194)


   

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

   

2-Amino-4-chlorothiazole-5-carbaldehyde

2-Amino-4-chlorothiazole-5-carbaldehyde

C4H3ClN2OS (161.96546179999999)


   

4-chlorothiophene-2-carboxylic acid

4-chlorothiophene-2-carboxylic acid

C5H3ClO2S (161.9542288)


   

SODIUM 2-OXOMALONATE

SODIUM 2-OXOMALONATE

C3Na2O5 (161.954115)


   

2-Bromo-1-cyclopropylethanone

2-Bromo-1-cyclopropylethanone

C5H7BrO (161.9680232)


   

4-Bromo-3,6-dihydro-2H-pyran

4-Bromo-3,6-dihydro-2H-pyran

C5H7BrO (161.9680232)


   

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)


   

Cyclopentanone, 2-bromo-

Cyclopentanone, 2-bromo-

C5H7BrO (161.9680232)


   

2,3-Dichlorophenol

2,3-Dichlorophenol

C6H4Cl2O (161.9639194)


   

5-Chloro-2-thiophenecarboxylic acid

5-Chloro-2-thiophenecarboxylic acid

C5H3ClO2S (161.9542288)


   

2-chloro-1,3-thiazole-4-carboxamide

2-chloro-1,3-thiazole-4-carboxamide

C4H3ClN2OS (161.96546179999999)


   

3,5-Dichlorophenol

3,5-Dichlorophenol

C6H4Cl2O (161.9639194)


   

3-Chlorothiophene-2-carboxylic acid

3-Chlorothiophene-2-carboxylic acid

C5H3ClO2S (161.9542288)


   

3-(Bromomethyl)cyclobutanone

3-(Bromomethyl)cyclobutanone

C5H7BrO (161.9680232)


   

Cyclobutanone,2-bromo-2-methyl-

Cyclobutanone,2-bromo-2-methyl-

C5H7BrO (161.9680232)


   

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)


   
   

4-Bromo-4-pentenal

4-Bromo-4-pentenal

C5H7BrO (161.9680232)


   
   

5-Chlorothiophene-3-carboxylic acid

5-Chlorothiophene-3-carboxylic acid

C5H3ClO2S (161.9542288)


   

4-methylthiadiazole-5-carbonyl chloride

4-methylthiadiazole-5-carbonyl chloride

C4H3ClN2OS (161.96546179999999)


   

3-BROMO-CYCLOPENT-2-ENOL

3-BROMO-CYCLOPENT-2-ENOL

C5H7BrO (161.9680232)


   

2-Thioxo1,3-thiazolidine-4-carboxylate

2-Thioxo1,3-thiazolidine-4-carboxylate

C4H4NO2S2- (161.9683464)


   

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.

   

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)