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

*Links on SpectraBase are not permalinks.
3-Methyl-2-thioxo-1,3-thiazepan-4-one
SpectraBase Compound ID 3EUdkMqgx9m
InChI InChI=1S/C6H9NOS2/c1-7-5(8)3-2-4-10-6(7)9/h2-4H2,1H3
InChIKey BQTLXGDJEISAJZ-UHFFFAOYSA-N
Mol Weight 175.26 g/mol
Molecular Formula C6H9NOS2
Exact Mass 175.012556 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 L8xienAuvOA
Name 3-METHYL-2-THIOXO-1,3-THIAZEPAN-4-ONE
Compound Number 6A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H9NOS2
InChI InChI=1S/C6H9NOS2/c1-7-5(8)3-2-4-10-6(7)9/h2-4H2,1H3
InChIKey BQTLXGDJEISAJZ-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 175.264 g/mol
Solvent CDCl3
Source File Reference UWSI24518