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3-Benzhydrylmercapto-2,4-dimethyl-1,3-pentadiene
SpectraBase Compound ID F38QP5ttr2V
InChI InChI=1S/C20H22S/c1-15(2)19(16(3)4)21-20(17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14,20H,1H2,2-4H3
InChIKey XMKAKCWTHVYUQC-UHFFFAOYSA-N
Mol Weight 294.46 g/mol
Molecular Formula C20H22S
Exact Mass 294.144222 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IQWLL9Ss3cT
Name 3-Benzhydrylmercapto-2,4-dimethyl-1,3-pentadiene
Alternate Name(s) benzhydryl(2,4-dimethylpenta-1,3-dien-3-yl)sulfane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22S
InChI InChI=1S/C20H22S/c1-15(2)19(16(3)4)21-20(17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14,20H,1H2,2-4H3
InChIKey XMKAKCWTHVYUQC-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cber.19721050626
Molecular Weight 294.456 g/mol
SMILES C(=C(C)C)(C(C)=C)SC(c1ccccc1)c1ccccc1
SPLASH splash10-014i-0900000000-c7b16d4d0a7c1ef72f1e
Source of Spectrum K-105-2006-3a
Wiley ID 1794726