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

*Links on SpectraBase are not permalinks.
4-(PARA-CHLOROPHENYL)-1,5-BENZOXATHIEPIN-2-ONE
SpectraBase Compound ID DeMi7Zs50q
InChI InChI=1S/C15H11ClO2S/c16-11-7-5-10(6-8-11)14-9-15(17)18-12-3-1-2-4-13(12)19-14/h1-8,14H,9H2
InChIKey VIJAHAIPDNDAFK-UHFFFAOYSA-N
Mol Weight 290.76 g/mol
Molecular Formula C15H11ClO2S
Exact Mass 290.016828 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 AyhV3u3af0t
Name 4-(PARA-CHLOROPHENYL)-1,5-BENZOXATHIEPIN-2-ONE
Compound Number 1C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H11ClO2S
InChI InChI=1S/C15H11ClO2S/c16-11-7-5-10(6-8-11)14-9-15(17)18-12-3-1-2-4-13(12)19-14/h1-8,14H,9H2
InChIKey VIJAHAIPDNDAFK-UHFFFAOYSA-N
Literature Reference Author A.C.GELEBE,P.T.KAYE,R.KLEIN,J.D.SEWRY,A.G.SOPER
Literature Reference Citation MAGN.RES.CHEM.,43,952(2005)
Literature Reference DOI 10.1002/mrc.1649
Molecular Weight 290.764 g/mol
Sample ID 32711
Solvent CDCl3