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1-Propanethione, 1-[6-(1,1-dimethylethyl)-3,4-dihydro-2,4-diphenyl-2H-thiopyran-3-yl]-2,2-dimethyl-
SpectraBase Compound ID ExdtUOZCxQH
InChI InChI=1S/C26H32S2/c1-25(2,3)21-17-20(18-13-9-7-10-14-18)22(24(27)26(4,5)6)23(28-21)19-15-11-8-12-16-19/h7-17,20,22-23H,1-6H3
InChIKey TYPHIQVRLASLDB-UHFFFAOYSA-N
Mol Weight 408.7 g/mol
Molecular Formula C26H32S2
Exact Mass 408.194543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FWtMJfLvfTt
Name 1-Propanethione, 1-[6-(1,1-dimethylethyl)-3,4-dihydro-2,4-diphenyl-2H-thiopyran-3-yl]-2,2-dimethyl-
CAS Registry Number 105867-46-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H32S2
InChI InChI=1S/C26H32S2/c1-25(2,3)21-17-20(18-13-9-7-10-14-18)22(24(27)26(4,5)6)23(28-21)19-15-11-8-12-16-19/h7-17,20,22-23H,1-6H3
InChIKey TYPHIQVRLASLDB-UHFFFAOYSA-N
Molecular Weight 408.662 g/mol
SMILES C1(C(SC(=CC1c1ccccc1)C(C)(C)C)c1ccccc1)C(C(C)(C)C)=S
SPLASH splash10-0002-0930000000-9386c9c8442ebc6c646e
Source of Spectrum AJ-59-65-6
Synonyms 2H-Thiopyran, 1-propanethione deriv. 1-(6-tert-butyl-2,4-diphenyl-3,4-dihydro-2H-thiopyran-3-yl)-2,2-dimethyl-1-propanethione 6-t-butyl-3-[t-butyl(thiocarbonyl)]-2,4-diphenyl-3,4-dihydro-2H-thiin
Wiley ID 1373134