For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Butanoic acid, 4-(4-methylphenyl)-4-oxo-, thiosemicarbazone
SpectraBase Compound ID 8DE4yY0VC2d
InChI InChI=1S/C12H15N3O2S/c1-8-2-4-9(5-3-8)10(6-7-11(16)17)14-15-12(13)18/h2-5H,6-7H2,1H3,(H,16,17)(H3,13,15,18)/b14-10+
InChIKey KJLFIWDLAKDVSM-GXDHUFHOSA-N
Mol Weight 265.33 g/mol
Molecular Formula C12H15N3O2S
Exact Mass 265.088498 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID JbpPu66gjYA
Name Butanoic acid, 4-(4-methylphenyl)-4-oxo-, thiosemicarbazone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15N3O2S
InChI InChI=1S/C12H15N3O2S/c1-8-2-4-9(5-3-8)10(6-7-11(16)17)14-15-12(13)18/h2-5H,6-7H2,1H3,(H,16,17)(H3,13,15,18)/b14-10+
InChIKey KJLFIWDLAKDVSM-GXDHUFHOSA-N
Molecular Weight 265.331 g/mol
SMILES OC(CC\C(=N/NC(=S)N)c1ccc(cc1)C)=O
SPLASH splash10-0006-5910000000-1f52839ecd8c64f4aadf
Synonyms (4E)-4-(carbamothioylhydrazinylidene)-4-(4-methylphenyl)butanoic acid (4E)-4-(carbamothioylhydrazono)-4-(p-tolyl)butanoic acid (4E)-4-(p-tolyl)-4-(thiocarbamoylhydrazono)butyric acid (4E)-4-[(Aminocarbothioyl)hydrazono]-4-(4-methylphenyl)butanoic acid
Wiley ID 1437677