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2-Mercaptoimidazole
SpectraBase Compound ID AKumPqAYatk
InChI InChI=1S/C3H4N2S/c6-3-4-1-2-5-3/h1-2H,(H2,4,5,6)
InChIKey OXFSTTJBVAAALW-UHFFFAOYSA-N
Mol Weight 100.14 g/mol
Molecular Formula C3H4N2S
Exact Mass 100.009519 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bh9L2PyJbCt
Name 2H-Imidazole-2-thione, 1,3-dihydro-
CAS Registry Number 872-35-5
Comments Structure changed after expert review
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C3H4N2S
InChI InChI=1S/C3H4N2S/c6-3-4-1-2-5-3/h1-2H,(H2,4,5,6)
InChIKey OXFSTTJBVAAALW-UHFFFAOYSA-N
Molecular Weight 100.139 g/mol
SMILES N1C(=S)NC=C1
SPLASH splash10-0udi-9600000000-2ee50d0cc1fb0d0330a3
Source of Spectrum B-20-1613-25
Synonyms 1,3-Dihydroimidazole-2-thione Imidazole-2-thiol 1,3-Vinylenethiourea 1H-Imidazole-2-thiol 2-Mercaptoimidazole 2-Thioxo-2,3-dihydroimidazole 4-Imidazoline-2-thione Imidazole, 2-mercapto- 1,3-Dihydro-2H-imidazole-2-thione 2-Mercapto-1H-imidazole USAF EL-57 NSC 112715
Wiley ID 1653