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3,5-Dimethyl-4-[(E)-C-methyl-N-thioureido-carbonimidoyl]pyrazole-1-carbothioamide
SpectraBase Compound ID 4vNVzdcms28
InChI InChI=1S/C9H14N6S2/c1-4(12-13-8(10)16)7-5(2)14-15(6(7)3)9(11)17/h1-3H3,(H2,11,17)(H3,10,13,16)/b12-4+
InChIKey FKPXDZYBBKJEAI-UUILKARUSA-N
Mol Weight 270.37 g/mol
Molecular Formula C9H14N6S2
Exact Mass 270.072137 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gq9s0abzORd
Name 3,5-Dimethyl-4-[(E)-C-methyl-N-thioureido-carbonimidoyl]pyrazole-1-carbothioamide
Alternate Name(s) 4-[(1E)-1-(carbamothioylhydrazinylidene)ethyl]-3,5-dimethyl-1-pyrazolecarbothioamide 4-[(E)-N-(carbamothioylamino)-C-methyl-carbonimidoyl]-3,5-dimethyl-pyrazole-1-carbothioamide
CAS Registry Number 132369-03-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14N6S2
InChI InChI=1S/C9H14N6S2/c1-4(12-13-8(10)16)7-5(2)14-15(6(7)3)9(11)17/h1-3H3,(H2,11,17)(H3,10,13,16)/b12-4+
InChIKey FKPXDZYBBKJEAI-UUILKARUSA-N
Molecular Weight 270.373 g/mol
SMILES N(C(=S)N)\N=C\(c1c(n[n](C(=S)N)c1C)C)C
SPLASH splash10-08mj-5980000000-8b4d51ca1a24d3a48db7
Source of Spectrum Y-27-1567-7
Wiley ID 1273611