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

*Links on SpectraBase are not permalinks.
(3Z,5Z)-3,5-Bis(4-methylbenzylidene)-tetrahydrothiopyran-4-one
SpectraBase Compound ID 9sLOwx4bpod
InChI InChI=1S/C21H20OS/c1-15-3-7-17(8-4-15)11-19-13-23-14-20(21(19)22)12-18-9-5-16(2)6-10-18/h3-12H,13-14H2,1-2H3/b19-11+,20-12+
InChIKey ZUKCNQCIARMDLU-AYKLPDECSA-N
Mol Weight 320.45 g/mol
Molecular Formula C21H20OS
Exact Mass 320.123486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Lnlf5JyuTku
Name (3Z,5Z)-3,5-Bis(4-methylbenzylidene)-tetrahydrothiopyran-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20OS
InChI InChI=1S/C21H20OS/c1-15-3-7-17(8-4-15)11-19-13-23-14-20(21(19)22)12-18-9-5-16(2)6-10-18/h3-12H,13-14H2,1-2H3/b19-11+,20-12+
InChIKey ZUKCNQCIARMDLU-AYKLPDECSA-N
Literature Reference DOI 10.1002/hc.20252
Molecular Weight 320.450 g/mol
SMILES C1\C(C(\C(CS1)=C\c1ccc(cc1)C)=O)=C/c1ccc(cc1)C
SPLASH splash10-0159-0902000000-457b7e76e4a6433ca0a7
Source of Spectrum HAC-18-47-2c
Synonyms 3,5-bis((Z)-4-methylbenzylidene)tetrahydro-4H-thiopyran-4-one
Wiley ID 1783746