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1H-Pyrazole-4-carboxylic acid, 5-[[2-[(methylamino)carbonothioyl]hydrazono]methyl]-1-phenyl-, methyl ester
SpectraBase Compound ID JP2jpCcwuTY
InChI InChI=1S/C14H15N5O2S/c1-15-14(22)18-16-9-12-11(13(20)21-2)8-17-19(12)10-6-4-3-5-7-10/h3-9H,1-2H3,(H2,15,18,22)/b16-9+
InChIKey SLKMXSUAUBGXQV-CXUHLZMHSA-N
Mol Weight 317.37 g/mol
Molecular Formula C14H15N5O2S
Exact Mass 317.094646 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F4VmOPOtHC4
Name 1H-Pyrazole-4-carboxylic acid, 5-[[2-[(methylamino)carbonothioyl]hydrazono]methyl]-1-phenyl-, methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H15N5O2S
InChI InChI=1S/C14H15N5O2S/c1-15-14(22)18-16-9-12-11(13(20)21-2)8-17-19(12)10-6-4-3-5-7-10/h3-9H,1-2H3,(H2,15,18,22)/b16-9+
InChIKey SLKMXSUAUBGXQV-CXUHLZMHSA-N
Molecular Weight 317.367 g/mol
SMILES N(C(=S)NC)\N=C\c1c(cn[n]1-c1ccccc1)C(=O)OC
SPLASH splash10-072a-9530000000-65292c343a9276114f79
Synonyms 5-[(E)-(methylthiocarbamoylhydrazono)methyl]-1-phenyl-pyrazole-4-carboxylic acid methyl ester 5-[(E)-[[methylamino(sulfanylidene)methyl]hydrazinylidene]methyl]-1-phenyl-4-pyrazolecarboxylic acid methyl ester Methyl 5-[(E)-(methylcarbamothioylhydrazinylidene)methyl]-1-phenyl-pyrazole-4-carboxylate Methyl 5-[(E)-(methylcarbamothioylhydrazono)methyl]-1-phenyl-pyrazole-4-carboxylate
Wiley ID 1466490