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1,4-Benzodithiin, 2,3,5,6,7,8-hexahydro-2,3-diphenyl-, cis-
SpectraBase Compound ID CHyfvtZpNvT
InChI InChI=1S/C20H20S2/c1-3-9-15(10-4-1)19-20(16-11-5-2-6-12-16)22-18-14-8-7-13-17(18)21-19/h1-6,9-12,19-20H,7-8,13-14H2/t19-,20+
InChIKey PRLMWNMCJFKDKZ-BGYRXZFFSA-N
Mol Weight 324.5 g/mol
Molecular Formula C20H20S2
Exact Mass 324.100643 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DWmNZ3x3i3x
Name 1,4-Benzodithiin, 2,3,5,6,7,8-hexahydro-2,3-diphenyl-, cis-
CAS Registry Number 127196-64-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20S2
InChI InChI=1S/C20H20S2/c1-3-9-15(10-4-1)19-20(16-11-5-2-6-12-16)22-18-14-8-7-13-17(18)21-19/h1-6,9-12,19-20H,7-8,13-14H2/t19-,20+
InChIKey PRLMWNMCJFKDKZ-BGYRXZFFSA-N
Molecular Weight 324.500 g/mol
SMILES [C@]1(SC2=C(S[C@]1(c1ccccc1)[H])CCCC2)(c1ccccc1)[H]
SPLASH splash10-00b9-0954000000-8408dc25df652886813f
Source of Spectrum KC-1989-2315-14
Synonyms (2R,3S)-2,3-diphenyl-2,3,5,6,7,8-hexahydro-1,4-benzodithiin cis-2,3,5,6,7,8-hexahydro-2,3-diphenyl-1,4-benzodithiin
Wiley ID 1323458