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4-(p-Tolylsulfonyl)butyric acid, (alpha-methylbenzylidene)hydrazide

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 UV-Vis

4-(p-Tolylsulfonyl)butyric acid, (alpha-methylbenzylidene)hydrazide
SpectraBase Compound ID ITESQ5AUoSV
InChI InChI=1S/C19H22N2O3S/c1-15-10-12-18(13-11-15)25(23,24)14-6-9-19(22)21-20-16(2)17-7-4-3-5-8-17/h3-5,7-8,10-13H,6,9,14H2,1-2H3,(H,21,22)/b20-16+
InChIKey AKUKEBBLGIKYPP-CAPFRKAQSA-N
Mol Weight 358.46 g/mol
Molecular Formula C19H22N2O3S
Exact Mass 358.135114 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DOuvHfSHOZL
Name 4-(p-Tolylsulfonyl)butyric acid, (alpha-methylbenzylidene)hydrazide
Comments Computed using HOSE algorithm
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Exact Mass 358.135113747 u
Formula C19H22N2O3S
InChI InChI=1S/C19H22N2O3S/c1-15-10-12-18(13-11-15)25(23,24)14-6-9-19(22)21-20-16(2)17-7-4-3-5-8-17/h3-5,7-8,10-13H,6,9,14H2,1-2H3,(H,21,22)/b20-16+
InChIKey AKUKEBBLGIKYPP-CAPFRKAQSA-N
Molecular Weight 358.456 g/mol
SMILES N(C(CCCS(C1=CC=C(C=C1)C)(=O)=O)=O)\N=C\(C=1C=CC=CC1)C