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2-(4-Oxo-4,5-dihydrothiazol-2-yl)-3-(p-tolyl)-but-2-enenitrile
SpectraBase Compound ID 1mcdP918SoC
InChI InChI=1S/C14H12N2OS/c1-9-3-5-11(6-4-9)10(2)12(7-15)14-16-13(17)8-18-14/h3-6H,8H2,1-2H3
InChIKey RBLDXLQEJZJMAW-UHFFFAOYSA-N
Mol Weight 256.32 g/mol
Molecular Formula C14H12N2OS
Exact Mass 256.067034 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5M2ctTta8eS
Name 2-(4-Oxo-4,5-dihydrothiazol-2-yl)-3-(p-tolyl)-but-2-enenitrile
Appearance Brown crystals
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Formula C14H12N2OS
InChI InChI=1S/C14H12N2OS/c1-9-3-5-11(6-4-9)10(2)12(7-15)14-16-13(17)8-18-14/h3-6H,8H2,1-2H3
InChIKey RBLDXLQEJZJMAW-UHFFFAOYSA-N
Instrument Name Hewlett Packard 5988 A or Shimadzu QP 1000 Ex
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3870
Molecular Weight 256.323 g/mol
SMILES C1(=O)N=C(SC1)C(C#N)=C(C)c1ccc(cc1)C
SPLASH splash10-001i-9000000000-3a4d40b6fd659d661170
Source of Spectrum Y-57-1337-2c
Wiley ID 1860085