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4-(4-Methoxyphenyl)-2-phenyl-4,4a,5,6,7,8-hexahydro-1-benzothiopyran-8a-thiol
SpectraBase Compound ID INkWiMDEb6f
InChI InChI=1S/C22H24OS2/c1-23-18-12-10-16(11-13-18)19-15-21(17-7-3-2-4-8-17)25-22(24)14-6-5-9-20(19)22/h2-4,7-8,10-13,15,19-20,24H,5-6,9,14H2,1H3
InChIKey XBNFAXGTIQLGTL-UHFFFAOYSA-N
Mol Weight 368.55 g/mol
Molecular Formula C22H24OS2
Exact Mass 368.126858 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K5xdzlWbIY9
Name 4-(4-Methoxyphenyl)-2-phenyl-4,4a,5,6,7,8-hexahydro-1-benzothiopyran-8a-thiol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H24OS2
InChI InChI=1S/C22H24OS2/c1-23-18-12-10-16(11-13-18)19-15-21(17-7-3-2-4-8-17)25-22(24)14-6-5-9-20(19)22/h2-4,7-8,10-13,15,19-20,24H,5-6,9,14H2,1H3
InChIKey XBNFAXGTIQLGTL-UHFFFAOYSA-N
Molecular Weight 368.553 g/mol
SMILES SC12C(CCCC2)C(C=C(S1)c1ccccc1)c1ccc(cc1)OC
SPLASH splash10-00di-7933000000-424207c159483cfc5d48
Synonyms 4-(4-Methoxyphenyl)-2-phenyl-4,4a,5,6,7,8-hexahydro-8ah-thiochromen-8a-yl hydrosulfide 4-(4-Methoxyphenyl)-2-phenyl-4,4a,5,6,7,8-hexahydro-8ah-thiochromene-8a-thiol 4-(4-Methoxyphenyl)-2-phenyl-4,4a,5,6,7,8-hexahydrothiochromene-8a-thiol 4a,5,6,7,8,8a-Hexahydro-4-(4-methoxyphenyl)-2-phenyl-4H-thiochromene-8a-thiol
Wiley ID 1468337