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

*Links on SpectraBase are not permalinks.
3-Methoxy-4-methyl-2-phenyl-4-(phenylthio)-2-cyclobuten-1-one
SpectraBase Compound ID DQT42kcTQqb
InChI InChI=1S/C18H16O2S/c1-18(21-14-11-7-4-8-12-14)16(19)15(17(18)20-2)13-9-5-3-6-10-13/h3-12H,1-2H3
InChIKey SOEISCMSAZOXIA-UHFFFAOYSA-N
Mol Weight 296.38 g/mol
Molecular Formula C18H16O2S
Exact Mass 296.087101 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 LJOWhLx5gCk
Name 3-Methoxy-4-methyl-2-phenyl-4-(phenylthio)-2-cyclobuten-1-one
CAS Registry Number 137395-12-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16O2S
InChI InChI=1S/C18H16O2S/c1-18(21-14-11-7-4-8-12-14)16(19)15(17(18)20-2)13-9-5-3-6-10-13/h3-12H,1-2H3
InChIKey SOEISCMSAZOXIA-UHFFFAOYSA-N
Molecular Weight 296.384 g/mol
SMILES C1(C(OC)=C(C1=O)c1ccccc1)(Sc1ccccc1)C
SPLASH splash10-0a4i-1900000000-f3f6690d714d31779b6d
Source of Spectrum J-57-336-0
Synonyms 3-Methoxy-4-methyl-2-phenyl-4-(phenylsulfanyl)-2-cyclobuten-1-one
Wiley ID 1299251