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

*Links on SpectraBase are not permalinks.
p-(tetrahydro-2H-1,2-thiazin-2-yl)benzoic acid, p-chlorophenyl ester, S,S-dioxide
SpectraBase Compound ID 1e1u40yqzsG
InChI InChI=1S/C17H16ClNO4S/c18-14-5-9-16(10-6-14)23-17(20)13-3-7-15(8-4-13)19-11-1-2-12-24(19,21)22/h3-10H,1-2,11-12H2
InChIKey GLKHNGQWFJAEAJ-UHFFFAOYSA-N
Mol Weight 365.83 g/mol
Molecular Formula C17H16ClNO4S
Exact Mass 365.048857 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 ARXiLoZdl6N
Name p-(Tetrahydro-2H-1,2-thiazin-2-yl)benzoic acid, p-chlorophenyl ester, S,S-dioxide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 365.048856869 u
Formula C17H16ClNO4S
InChI InChI=1S/C17H16ClNO4S/c18-14-5-9-16(10-6-14)23-17(20)13-3-7-15(8-4-13)19-11-1-2-12-24(19,21)22/h3-10H,1-2,11-12H2
InChIKey GLKHNGQWFJAEAJ-UHFFFAOYSA-N
Molecular Weight 365.831 g/mol
SMILES C=1C(=CC=C(C1)N1S(CCCC1)(=O)=O)C(OC=1C=CC(=CC1)Cl)=O