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

*Links on SpectraBase are not permalinks.
(3E)-3-(4-isopropylbenzylidene)thiochroman-4-one
SpectraBase Compound ID K5iQumDYyyb
InChI InChI=1S/C19H18OS/c1-13(2)15-9-7-14(8-10-15)11-16-12-21-18-6-4-3-5-17(18)19(16)20/h3-11,13H,12H2,1-2H3/b16-11-
InChIKey ORIHWEDAJTXQTI-WJDWOHSUSA-N
Mol Weight 294.41 g/mol
Molecular Formula C19H18OS
Exact Mass 294.107836 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 CRRx5J6UkSk
Name (3E)-3-(4-isopropylbenzylidene)thiochroman-4-one
Compound Number 1B-Z
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H18OS
InChI InChI=1S/C19H18OS/c1-13(2)15-9-7-14(8-10-15)11-16-12-21-18-6-4-3-5-17(18)19(16)20/h3-11,13H,12H2,1-2H3/b16-11-
InChIKey ORIHWEDAJTXQTI-WJDWOHSUSA-N
Literature Reference Author G.TOTH,J.HALASZ,A.LEVAI,C.NEMES,T.PATONAY
Literature Reference Citation J.CHEM.SOC.PERKIN-2,547(1996)
Literature Reference DOI 10.1039/p29960000547
Molecular Weight 294.411 g/mol
Solvent C6D6
Source File Reference UWCP8179