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(1'RS,2'E,3RS,RsSs)-3-[1'-[2'-dimethyl(1,1-dimethylethyl)siloxy]ethyl]-3'-(phenylsulfinyl)prop-2'-enyl]cyclopentanone
SpectraBase Compound ID Kzcg0ROgrxp
InChI InChI=1S/C22H34O3SSi/c1-17(25-27(5,6)22(2,3)4)21(18-12-13-19(23)16-18)14-15-26(24)20-10-8-7-9-11-20/h7-11,14-15,17-18,21H,12-13,16H2,1-6H3/b15-14+
InChIKey DTQUXKPRGIHCPC-CCEZHUSRSA-N
Mol Weight 406.7 g/mol
Molecular Formula C22H34O3SSi
Exact Mass 406.199793 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ez8MzumaKVB
Name (1'RS,2'E,3RS,RsSs)-3-[1'-[2'-dimethyl(1,1-dimethylethyl)siloxy]ethyl]-3'-(phenylsulfinyl)prop-2'-enyl]cyclopentanone
CAS Registry Number 114691-80-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H34O3SSi
InChI InChI=1S/C22H34O3SSi/c1-17(25-27(5,6)22(2,3)4)21(18-12-13-19(23)16-18)14-15-26(24)20-10-8-7-9-11-20/h7-11,14-15,17-18,21H,12-13,16H2,1-6H3/b15-14+
InChIKey DTQUXKPRGIHCPC-CCEZHUSRSA-N
Molecular Weight 406.656 g/mol
SMILES c1(S(\C=C\C(C2CC(=O)CC2)C(O[Si](C(C)(C)C)(C)C)C)=O)ccccc1
SPLASH splash10-001k-0009000000-c8ba563fccbd65c01192
Source of Spectrum C-110-5420-42
Synonyms 3-[(2E)-1-(1-{[tert-butyl(dimethyl)silyl]oxy}ethyl)-3-(phenylsulfinyl)-2-propenyl]cyclopentanone
Wiley ID 1372169