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Acetic acid, 2-(1H-1,3-benzimidazol-2-ylthio)-, ethyl ester

View entire compound with spectra: 1 MS (GC)

Acetic acid, 2-(1H-1,3-benzimidazol-2-ylthio)-, ethyl ester
SpectraBase Compound ID 7Lux9XIq3K1
InChI InChI=1S/C11H12N2O2S/c1-2-15-10(14)7-16-11-12-8-5-3-4-6-9(8)13-11/h3-6H,2,7H2,1H3,(H,12,13)
InChIKey TZMSMSYMMHOSOE-UHFFFAOYSA-N
Mol Weight 236.29 g/mol
Molecular Formula C11H12N2O2S
Exact Mass 236.061949 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AVbWdlhgtCh
Name Acetic acid, 2-(1H-1,3-benzimidazol-2-ylthio)-, ethyl ester
Alternate Name(s) Ethyl 2-(1H-1,3-benzodiazol-2-ylsulfanyl)acetate Ethyl 2-(1H-benzimidazol-2-ylsulfanyl)acetate Ethyl 2-(1H-benzimidazol-2-ylsulfanyl)ethanoate
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Formula C11H12N2O2S
InChI InChI=1S/C11H12N2O2S/c1-2-15-10(14)7-16-11-12-8-5-3-4-6-9(8)13-11/h3-6H,2,7H2,1H3,(H,12,13)
InChIKey TZMSMSYMMHOSOE-UHFFFAOYSA-N
Molecular Weight 236.289 g/mol
SMILES [nH]1c2ccccc2nc1SCC(=O)OCC
SPLASH splash10-03di-9810000000-6a898d286e0a8f635ad0
Source of Spectrum IY-2-4940-9
Wiley ID 1657392