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1,3-Dioxolane, 4-[bis[(4-methylphenyl)thio]methyl]-2,2-dimethyl-5-phenyl-, (4S-trans)-
SpectraBase Compound ID 9YS6tfPjTGu
InChI InChI=1S/C26H28O2S2/c1-18-10-14-21(15-11-18)29-25(30-22-16-12-19(2)13-17-22)24-23(27-26(3,4)28-24)20-8-6-5-7-9-20/h5-17,23-25H,1-4H3/t23-,24+/m1/s1
InChIKey ZMNDSMWLDPYIFC-RPWUZVMVSA-N
Mol Weight 436.63 g/mol
Molecular Formula C26H28O2S2
Exact Mass 436.153072 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FQq12983cYN
Name 1,3-Dioxolane, 4-[bis[(4-methylphenyl)thio]methyl]-2,2-dimethyl-5-phenyl-, (4S-trans)-
CAS Registry Number 130796-29-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H28O2S2
InChI InChI=1S/C26H28O2S2/c1-18-10-14-21(15-11-18)29-25(30-22-16-12-19(2)13-17-22)24-23(27-26(3,4)28-24)20-8-6-5-7-9-20/h5-17,23-25H,1-4H3/t23-,24+/m1/s1
InChIKey ZMNDSMWLDPYIFC-RPWUZVMVSA-N
Molecular Weight 436.628 g/mol
SMILES [C@]1(C(Sc2ccc(cc2)C)Sc2ccc(cc2)C)([C@](OC(O1)(C)C)(c1ccccc1)[H])[H]
SPLASH splash10-0a4i-1790000000-3d47317a482c4caf0f97
Source of Spectrum B-43-1207-0
Synonyms (4S,5R)-4-{bis[(4-methylphenyl)sulfanyl]methyl}-2,2-dimethyl-5-phenyl-1,3-dioxolane (4S,5R)-trans-4-[bis(p-tolylthio)methyl]-2,2-dimethyl-5-phenyl-1,3-dioxolan
Wiley ID 1383594