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2-Cyclohexen-1-ol, 2-[5-(2-bromoethyl)-2-methoxyphenoxy]-4-(phenylsulfonyl)-3-(2-propenyl)-
SpectraBase Compound ID D1kLV9apoAb
InChI InChI=1S/C24H27BrO5S/c1-3-7-19-23(31(27,28)18-8-5-4-6-9-18)13-11-20(26)24(19)30-22-16-17(14-15-25)10-12-21(22)29-2/h3-6,8-10,12,16,20,23,26H,1,7,11,13-15H2,2H3
InChIKey GPFMUUZXAZPMJV-UHFFFAOYSA-N
Mol Weight 507.44 g/mol
Molecular Formula C24H27BrO5S
Exact Mass 506.076258 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BDiXsg8NXav
Name 2-Cyclohexen-1-ol, 2-[5-(2-bromoethyl)-2-methoxyphenoxy]-4-(phenylsulfonyl)-3-(2-propenyl)-
CAS Registry Number 115961-41-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H27BrO5S
InChI InChI=1S/C24H27BrO5S/c1-3-7-19-23(31(27,28)18-8-5-4-6-9-18)13-11-20(26)24(19)30-22-16-17(14-15-25)10-12-21(22)29-2/h3-6,8-10,12,16,20,23,26H,1,7,11,13-15H2,2H3
InChIKey GPFMUUZXAZPMJV-UHFFFAOYSA-N
Molecular Weight 507.439 g/mol
SMILES OC1CCC(C(=C1Oc1c(ccc(c1)CCBr)OC)CC=C)S(=O)(=O)c1ccccc1
SPLASH splash10-015j-0963000000-5412be1a568fb4c3cbd8
Source of Spectrum J-53-4706-42
Synonyms 3-Allyl-2-[5-(2-bromoethyl)-2-methoxyphenoxy]-4-(phenylsulfonyl)-2-cyclohexen-1-ol cis-2-(3'-(2''-bromoethyl)-6'-methoxyphenoxy)-1-hydroxy-3-(2'''-propen-1'''-ylidene)-4-(phenylsulfonyl)cyclohexane cis-2-(3'-(2''-bromoethyl)-6'-methoxyphenoxy)-1-hydroxy-3-(2'''-propen-1'''-ylidene)-4-(phenylsulfonyl)cyclohexane
Wiley ID 1399794