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

*Links on SpectraBase are not permalinks.

3-Phenyl-2-thioxo-1,3-thiazepan-4-one

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

3-Phenyl-2-thioxo-1,3-thiazepan-4-one
SpectraBase Compound ID EL937nmTMQT
InChI InChI=1S/C11H11NOS2/c13-10-7-4-8-15-11(14)12(10)9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2
InChIKey DLEYZQCLBGSQDI-UHFFFAOYSA-N
Mol Weight 237.33 g/mol
Molecular Formula C11H11NOS2
Exact Mass 237.028206 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 LQJQkhJPnjR
Name 3-PHENYL-2-THIOXO-1,3-THIAZEPAN-4-ONE
Compound Number 6F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H11NOS2
InChI InChI=1S/C11H11NOS2/c13-10-7-4-8-15-11(14)12(10)9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2
InChIKey DLEYZQCLBGSQDI-UHFFFAOYSA-N
Literature Reference Author W.HANEFELD,H.SCHUETZ
Literature Reference Citation J.HETCYCL.CHEM.,36,1167(1999)
Literature Reference DOI 10.1002/jhet.5570360509
Molecular Weight 237.334 g/mol
Solvent CDCl3
Source File Reference UWSI24522