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2-[(1,3)-dioxolan-2'-yl]-3-[(o-methoxyphenyl)thio]-4-phenyl-4-acetoxybutane
SpectraBase Compound ID JgxpDPDVknh
InChI InChI=1S/C22H26O5S/c1-15(22-25-13-14-26-22)21(28-19-12-8-7-11-18(19)24-3)20(27-16(2)23)17-9-5-4-6-10-17/h4-12,15,20-22H,13-14H2,1-3H3
InChIKey KFKXVOOLZUTMTI-UHFFFAOYSA-N
Mol Weight 402.51 g/mol
Molecular Formula C22H26O5S
Exact Mass 402.150095 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5t5W2WuCHQp
Name 2-[(1,3)-dioxolan-2'-yl]-3-[(o-methoxyphenyl)thio]-4-phenyl-4-acetoxybutane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H26O5S
InChI InChI=1S/C22H26O5S/c1-15(22-25-13-14-26-22)21(28-19-12-8-7-11-18(19)24-3)20(27-16(2)23)17-9-5-4-6-10-17/h4-12,15,20-22H,13-14H2,1-3H3
InChIKey KFKXVOOLZUTMTI-UHFFFAOYSA-N
Molecular Weight 402.505 g/mol
SMILES C(C(C1OCCO1)C)(Sc1c(OC)cccc1)C(OC(=O)C)c1ccccc1
SPLASH splash10-00di-9210000000-8bdbcbf1ded07fb1d0c7
Source of Spectrum GT-1992-48-0
Synonyms 3-(1,3-dioxolan-2-yl)-2-[(2-methoxyphenyl)sulfanyl]-1-phenylbutyl acetate Acetic acid [3-(1,3-dioxolan-2-yl)-2-[(2-methoxyphenyl)thio]-1-phenylbutyl] ester [3-(1,3-dioxolan-2-yl)-2-(2-methoxyphenyl)sulfanyl-1-phenylbutyl] acetate [3-(1,3-dioxolan-2-yl)-2-(2-methoxyphenyl)sulfanyl-1-phenyl-butyl] acetate [3-(1,3-dioxolan-2-yl)-2-(2-methoxyphenyl)sulfanyl-1-phenyl-butyl] ethanoate
Wiley ID 161445