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(E)-2-(2-(3-Amino-5-oxo-1H-pyrazol-4(5H)-ylidene)hydrazinyl)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carbonitrile
SpectraBase Compound ID GgIW3wVdqw2
InChI InChI=1S/C12H12N6OS/c13-5-7-6-3-1-2-4-8(6)20-12(7)18-15-9-10(14)16-17-11(9)19/h18H,1-4H2,(H3,14,15,16,17,19)
InChIKey CYVNOEMWJSPGQT-UHFFFAOYSA-N
Mol Weight 288.33 g/mol
Molecular Formula C12H12N6OS
Exact Mass 288.07933 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5kn78RriXw4
Name (E)-2-(2-(3-Amino-5-oxo-1H-pyrazol-4(5H)-ylidene)hydrazinyl)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carbonitrile
Appearance Brown powder
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Exact Mass 288.079330203 u
Formula C12H12N6OS
InChI InChI=1S/C12H12N6OS/c13-5-7-6-3-1-2-4-8(6)20-12(7)18-15-9-10(14)16-17-11(9)19/h18H,1-4H2,(H3,14,15,16,17,19)
InChIKey CYVNOEMWJSPGQT-UHFFFAOYSA-N
Instrument Name Kratos MS
Ionization Type EI
Literature Reference DOI 10.1016/j.jscs.2012.06.004
Molecular Weight 288.329 g/mol
SMILES N(C1=C(C=2CCCCC2S1)C#N)\N=C/1C(=NNC1=O)N
SPLASH splash10-0006-0090000000-f2488cc2217be0e19951
Source of Spectrum SCS-20-155-6c (DOI: 10.1016/j.jscs.2012.06.004)
Wiley ID 1892594