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4-[(2,3,5,6-tetramethylphenyl)sulfonyl]-2-butanone thiosemicarbazone
SpectraBase Compound ID 7C13OzMnJmM
InChI InChI=1S/C15H23N3O2S2/c1-9-8-10(2)13(5)14(12(9)4)22(19,20)7-6-11(3)17-18-15(16)21/h8H,6-7H2,1-5H3,(H3,16,18,21)/b17-11-
InChIKey XDXXUVZHIABPGP-BOPFTXTBSA-N
Mol Weight 341.49 g/mol
Molecular Formula C15H23N3O2S2
Exact Mass 341.123169 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AydYxiPIYeh
Name 4-[(2,3,5,6-tetramethylphenyl)sulfonyl]-2-butanone thiosemicarbazone
Alternate Name(s) (2Z)-4-[(2,3,5,6-tetramethylphenyl)sulfonyl]-2-butanone thiosemicarbazone Thiosemicarbazide, 1-[1-methyl-3-(2,3, 5,6-tetramethylphenylsulfonyl)propenylideno]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H23N3O2S2
InChI InChI=1S/C15H23N3O2S2/c1-9-8-10(2)13(5)14(12(9)4)22(19,20)7-6-11(3)17-18-15(16)21/h8H,6-7H2,1-5H3,(H3,16,18,21)/b17-11-
InChIKey XDXXUVZHIABPGP-BOPFTXTBSA-N
Molecular Weight 341.488 g/mol
SMILES N(C(=S)N)\N=C/(CCS(c1c(c(C)cc(c1C)C)C)(=O)=O)C
SPLASH splash10-0296-9400000000-710349ba062e17ab3ab7
Wiley ID 1452875