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4-(2-Phenylimidazol-1-yl)thiobutyramide
SpectraBase Compound ID HoZteitq1ti
InChI InChI=1S/C13H15N3S/c14-12(17)7-4-9-16-10-8-15-13(16)11-5-2-1-3-6-11/h1-3,5-6,8,10H,4,7,9H2,(H2,14,17)
InChIKey JCXJYJHCMCRMFB-UHFFFAOYSA-N
Mol Weight 245.34 g/mol
Molecular Formula C13H15N3S
Exact Mass 245.098669 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Yk2QGMD7Oi
Name 4-(2-Phenylimidazol-1-yl)thiobutyramide
Comments Less than 3 mono-isotopic peaks
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Formula C13H15N3S
InChI InChI=1S/C13H15N3S/c14-12(17)7-4-9-16-10-8-15-13(16)11-5-2-1-3-6-11/h1-3,5-6,8,10H,4,7,9H2,(H2,14,17)
InChIKey JCXJYJHCMCRMFB-UHFFFAOYSA-N
Molecular Weight 245.344 g/mol
SMILES NC(CCC[n]1c(ncc1)-c1ccccc1)=S
SPLASH splash10-0udj-0960000000-70fc3828f8418177f133
Source of Spectrum F-69-7181-11
Synonyms 4-(2-phenyl-1-imidazolyl)butanethioamide
Wiley ID 1595754