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2-Butanone, 3-methyl-3-[(1-methyl-1H-imidazol-2-yl)thio]-
SpectraBase Compound ID 2BKfKFOzkmh
InChI InChI=1S/C9H14N2OS/c1-7(12)9(2,3)13-8-10-5-6-11(8)4/h5-6H,1-4H3
InChIKey VVDQJFRRCWWYBH-UHFFFAOYSA-N
Mol Weight 198.28 g/mol
Molecular Formula C9H14N2OS
Exact Mass 198.082684 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID dyCeAAgRpK
Name 2-Butanone, 3-methyl-3-[(1-methyl-1H-imidazol-2-yl)thio]-
CAS Registry Number 66165-19-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14N2OS
InChI InChI=1S/C9H14N2OS/c1-7(12)9(2,3)13-8-10-5-6-11(8)4/h5-6H,1-4H3
InChIKey VVDQJFRRCWWYBH-UHFFFAOYSA-N
Molecular Weight 198.284 g/mol
SMILES c1([n](ccn1)C)SC(C(=O)C)(C)C
SPLASH splash10-03di-0900000000-87e6efbb07f238931302
Source of Spectrum KC-1977-20-2284
Synonyms 3-Methyl-3-(1-methylimidazol-2-ylthio)butan-2-one 3-Methyl-3-[(1-methyl-1H-imidazol-2-yl)sulfanyl]-2-butanone
Wiley ID 1195046