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

*Links on SpectraBase are not permalinks.
8-(CARBOXAMIDINYLTHIO)-METHYL-2-(4'-CHLOROPHENYL)-6-METHYL-4H-1-BENZOPYRAN-4-ONE-HYDROBROMIDE
SpectraBase Compound ID sybvXlTY0M
InChI InChI=1S/C18H14BrClN2O2S/c1-10-6-12(9-25-18(21)22-19)17-14(7-10)15(23)8-16(24-17)11-2-4-13(20)5-3-11/h2-8H,9H2,1H3,(H2,21,22)
InChIKey KGYOQYQTCKQCHV-UHFFFAOYSA-N
Mol Weight 437.74 g/mol
Molecular Formula C18H14BrClN2O2S
Exact Mass 435.96479 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 DL3MFbokbFb
Name 8-(CARBOXAMIDINYLTHIO)-METHYL-2-(4'-CHLOROPHENYL)-6-METHYL-4H-1-BENZOPYRAN-4-ONE-HYDROBROMIDE
Compound Number 15 D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H14BrClN2O2S
InChI InChI=1S/C18H14BrClN2O2S/c1-10-6-12(9-25-18(21)22-19)17-14(7-10)15(23)8-16(24-17)11-2-4-13(20)5-3-11/h2-8H,9H2,1H3,(H2,21,22)
InChIKey KGYOQYQTCKQCHV-UHFFFAOYSA-N
Literature Reference Author R.A.AITKEN,M.C.BIBBY,J.A.DOUBLE,R.M.PHILLIPS,S.K.SHARMA
Literature Reference Citation ARCH.PHARM.,329,489(1996)
Literature Reference DOI 10.1002/ardp.19963291104
Molecular Weight 437.738 g/mol
Solvent CDCl3
Source File Reference UWRU10646