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3-(4-Methoxyphenyl)-7,8-dimethyl-1,5-dihydro-2,4-benzodithiepine
SpectraBase Compound ID 4koFYvfYUZ0
InChI InChI=1S/C18H20OS2/c1-12-8-15-10-20-18(21-11-16(15)9-13(12)2)14-4-6-17(19-3)7-5-14/h4-9,18H,10-11H2,1-3H3
InChIKey OVDPPMGEXHYHNE-UHFFFAOYSA-N
Mol Weight 316.48 g/mol
Molecular Formula C18H20OS2
Exact Mass 316.095558 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID nPwvyNQ6y
Name 3-(4-Methoxyphenyl)-7,8-dimethyl-1,5-dihydro-2,4-benzodithiepine
Alternate Name(s) 3-(4-Methoxyphenyl)-7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin Benzo[e]dithiepane, 3-(4-methoxyphenyl)-7,8-dimethyl-
CAS Registry Number 309286-88-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20OS2
InChI InChI=1S/C18H20OS2/c1-12-8-15-10-20-18(21-11-16(15)9-13(12)2)14-4-6-17(19-3)7-5-14/h4-9,18H,10-11H2,1-3H3
InChIKey OVDPPMGEXHYHNE-UHFFFAOYSA-N
Molecular Weight 316.477 g/mol
SMILES COc1ccc(C2SCc3c(CS2)cc(c(C)c3)C)cc1
SPLASH splash10-0w2a-2920000000-a65e039e4133636ea460
Source of Spectrum AD-0-2532-0
Wiley ID 1431366