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

*Links on SpectraBase are not permalinks.

Benzoic acid, 4-ethenyl-, 4-[(ethylsulfonyl)amino]phenyl ester

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Benzoic acid, 4-ethenyl-, 4-[(ethylsulfonyl)amino]phenyl ester
SpectraBase Compound ID 4vHqREZd3u2
InChI InChI=1S/C17H17NO4S/c1-3-13-5-7-14(8-6-13)17(19)22-16-11-9-15(10-12-16)18-23(20,21)4-2/h3,5-12,18H,1,4H2,2H3
InChIKey BCYQVECKCJMDCJ-UHFFFAOYSA-N
Mol Weight 331.39 g/mol
Molecular Formula C17H17NO4S
Exact Mass 331.087829 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 IDRb2TDVp1a
Name Benzoic acid, 4-ethenyl-, 4-[(ethylsulfonyl)amino]phenyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 331.087829201 u
Formula C17H17NO4S
InChI InChI=1S/C17H17NO4S/c1-3-13-5-7-14(8-6-13)17(19)22-16-11-9-15(10-12-16)18-23(20,21)4-2/h3,5-12,18H,1,4H2,2H3
InChIKey BCYQVECKCJMDCJ-UHFFFAOYSA-N
Molecular Weight 331.386 g/mol
SMILES CCS(=O)(=O)NC1=CC=C(OC(=O)C2=CC=C(C=C)C=C2)C=C1