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Acetic acid, (4,5-dihydro-1H-imidazol-2-ylthio)-
SpectraBase Compound ID AXgfbyYprzm
InChI InChI=1S/C5H8N2O2S/c8-4(9)3-10-5-6-1-2-7-5/h1-3H2,(H,6,7)(H,8,9)
InChIKey MXQQZVRKFFMIKG-UHFFFAOYSA-N
Mol Weight 160.19 g/mol
Molecular Formula C5H8N2O2S
Exact Mass 160.030649 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1UwffCwKRZL
Name Acetic acid, (4,5-dihydro-1H-imidazol-2-ylthio)-
Alternate Name(s) (4,5-Dihydro-1H-imidazol-2-ylsulfanyl)-acetic acid 2-(2-imidazolin-1-ium-2-ylthio)acetate 2-(2-imidazolin-2-ylthio)acetic acid 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)acetic acid 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)ethanoic acid 2-(4,5-dihydro-1H-imidazol-2-ylthio)acetic acid 2-(4,5-dihydro-1H-imidazol-3-ium-2-ylsulfanyl)acetate 2-(4,5-dihydro-1H-imidazol-3-ium-2-ylsulfanyl)ethanoate 2-(4,5-dihydro-1H-imidazol-3-ium-2-ylthio)acetate
CAS Registry Number 19951-23-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H8N2O2S
InChI InChI=1S/C5H8N2O2S/c8-4(9)3-10-5-6-1-2-7-5/h1-3H2,(H,6,7)(H,8,9)
InChIKey MXQQZVRKFFMIKG-UHFFFAOYSA-N
Molecular Weight 160.191 g/mol
SMILES N1C(SCC(O)=O)=NCC1
SPLASH splash10-006x-9400000000-0d85bdd6dc74157e0790
Source of Spectrum AD-0-2532-0
Wiley ID 1429658