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Ethyl 5-(2-(1-cyano-2-ethoxy-2-oxoethylidene)hydrazinyl)-3-(methylthio)-1H-pyrazole-4-carboxylate
SpectraBase Compound ID A10rXfI0cUB
InChI InChI=1S/C12H15N5O4S/c1-4-20-11(18)7(6-13)14-15-9-8(12(19)21-5-2)10(22-3)17-16-9/h4-5H2,1-3H3,(H2,15,16,17)
InChIKey QTAAXNNMWVFAJK-UHFFFAOYSA-N
Mol Weight 325.34 g/mol
Molecular Formula C12H15N5O4S
Exact Mass 325.084475 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6vgOgvpuDVj
Name Ethyl 5-(2-(1-cyano-2-ethoxy-2-oxoethylidene)hydrazinyl)-3-(methylthio)-1H-pyrazole-4-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15N5O4S
InChI InChI=1S/C12H15N5O4S/c1-4-20-11(18)7(6-13)14-15-9-8(12(19)21-5-2)10(22-3)17-16-9/h4-5H2,1-3H3,(H2,15,16,17)
InChIKey QTAAXNNMWVFAJK-UHFFFAOYSA-N
Literature Reference DOI 10.1002/jccs.200100017
Molecular Weight 325.343 g/mol
SMILES N(c1c(c(SC)n[nH]1)C(=O)OCC)N=C(C#N)C(OCC)=O
SPLASH splash10-004i-0093000000-43b35bbb16f4de91ed27
Source of Spectrum QA-48-97-24
Synonyms Ethyl 5-(2-(1-cyano-2-ethoxy-2-oxoethylidene)hydrazineyl)-3-(methylthio)-1H-pyrazole-4-carboxylate
Wiley ID 1795262