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

*Links on SpectraBase are not permalinks.
4-Oxopentanoic acid, p-tolylsulfonylhydrazone, ethyl ester
SpectraBase Compound ID LXe9KoeS3uL
InChI InChI=1S/C14H20N2O4S/c1-4-20-14(17)10-7-12(3)15-16-21(18,19)13-8-5-11(2)6-9-13/h5-6,8-9,16H,4,7,10H2,1-3H3/b15-12+
InChIKey IIPNNDGAHZQWGI-NTCAYCPXSA-N
Mol Weight 312.38 g/mol
Molecular Formula C14H20N2O4S
Exact Mass 312.114378 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID 3VMC4IHYvQs
Name 4-Oxopentanoic acid, p-tolylsulfonylhydrazone, ethyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 312.114378302 u
Formula C14H20N2O4S
InChI InChI=1S/C14H20N2O4S/c1-4-20-14(17)10-7-12(3)15-16-21(18,19)13-8-5-11(2)6-9-13/h5-6,8-9,16H,4,7,10H2,1-3H3/b15-12+
InChIKey IIPNNDGAHZQWGI-NTCAYCPXSA-N
Molecular Weight 312.384 g/mol
SMILES C=1(S(=O)(=O)N\N=C\(CCC(=O)OCC)C)C=CC(=CC1)C