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Acenaphthylene, 1,2-dihydro-1,2-bis[(4-methylphenyl)thio]-, cis-
SpectraBase Compound ID EL8D0f3qSnV
InChI InChI=1S/C26H22S2/c1-17-9-13-20(14-10-17)27-25-22-7-3-5-19-6-4-8-23(24(19)22)26(25)28-21-15-11-18(2)12-16-21/h3-16,25-26H,1-2H3/t25-,26+
InChIKey PQHGJDTYQNIGDS-WMPKNSHKSA-N
Mol Weight 398.58 g/mol
Molecular Formula C26H22S2
Exact Mass 398.116293 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6iettNChB1L
Name Acenaphthylene, 1,2-dihydro-1,2-bis[(4-methylphenyl)thio]-, cis-
CAS Registry Number 97841-02-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H22S2
InChI InChI=1S/C26H22S2/c1-17-9-13-20(14-10-17)27-25-22-7-3-5-19-6-4-8-23(24(19)22)26(25)28-21-15-11-18(2)12-16-21/h3-16,25-26H,1-2H3/t25-,26+
InChIKey PQHGJDTYQNIGDS-WMPKNSHKSA-N
Molecular Weight 398.582 g/mol
SMILES [C@]1([C@](c2cccc3c2c1ccc3)(Sc1ccc(cc1)C)[H])(Sc1ccc(cc1)C)[H]
SPLASH splash10-0fi0-0590000000-f832895a45d588be04d0
Source of Spectrum O-20-231-6
Synonyms (1R,2S)-1,2-bis[(4-methylphenyl)sulfanyl]-1,2-dihydroacenaphthylene cis-1,2-bis(para-tolylthio)acenaphthene
Wiley ID 1368638