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Methanethione, (3,4-dihydro-2,4,6-triphenyl-2H-thiopyran-3-yl)phenyl-
SpectraBase Compound ID GK8okumZFKR
InChI InChI=1S/C30H24S2/c31-29(24-17-9-3-10-18-24)28-26(22-13-5-1-6-14-22)21-27(23-15-7-2-8-16-23)32-30(28)25-19-11-4-12-20-25/h1-21,26,28,30H
InChIKey AHGCWYQQANHLHF-UHFFFAOYSA-N
Mol Weight 448.64 g/mol
Molecular Formula C30H24S2
Exact Mass 448.131943 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KA1drQT0gf6
Name Methanethione, (3,4-dihydro-2,4,6-triphenyl-2H-thiopyran-3-yl)phenyl-
Alternate Name(s) 2H-thiopyran, methanethione deriv. phenyl(2,4,6-triphenyl-3,4-dihydro-2H-thiopyran-3-yl)methanethione Thiochalcone dimer
CAS Registry Number 67254-57-3
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H24S2
InChI InChI=1S/C30H24S2/c31-29(24-17-9-3-10-18-24)28-26(22-13-5-1-6-14-22)21-27(23-15-7-2-8-16-23)32-30(28)25-19-11-4-12-20-25/h1-21,26,28,30H
InChIKey AHGCWYQQANHLHF-UHFFFAOYSA-N
Molecular Weight 448.642 g/mol
SMILES C1(C(SC(=CC1c1ccccc1)c1ccccc1)c1ccccc1)C(=S)c1ccccc1
SPLASH splash10-00di-0090000000-16952d9db0030847cfc4
Source of Spectrum J-43-4149-0
Wiley ID 1387357