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Benzene, 1-[[3-heptyl-2-(phenylseleno)-1-undecenyl]sulfonyl]-4-methyl-, (Z)-
SpectraBase Compound ID 93aG31oe2mu
InChI InChI=1S/C31H46O2SSe/c1-4-6-8-10-12-15-19-28(18-14-11-9-7-5-2)31(35-30-20-16-13-17-21-30)26-34(32,33)29-24-22-27(3)23-25-29/h13,16-17,20-26,28H,4-12,14-15,18-19H2,1-3H3/b31-26-
InChIKey OLHNURVRHPOKKY-ZXPTYKNPSA-N
Mol Weight 561.7 g/mol
Molecular Formula C31H46O2SSe
Exact Mass 562.238374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BgJ6Jld5EOy
Name Benzene, 1-[[3-heptyl-2-(phenylseleno)-1-undecenyl]sulfonyl]-4-methyl-, (Z)-
CAS Registry Number 122487-91-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H46O2SSe
InChI InChI=1S/C31H46O2SSe/c1-4-6-8-10-12-15-19-28(18-14-11-9-7-5-2)31(35-30-20-16-13-17-21-30)26-34(32,33)29-24-22-27(3)23-25-29/h13,16-17,20-26,28H,4-12,14-15,18-19H2,1-3H3/b31-26-
InChIKey OLHNURVRHPOKKY-ZXPTYKNPSA-N
Molecular Weight 561.739 g/mol
SMILES c1([Se]\C(=C/S(c2ccc(cc2)C)(=O)=O)C(CCCCCCCC)CCCCCCC)ccccc1
SPLASH splash10-052f-9200000000-c709791863537265145b
Source of Spectrum J-54-4152-0
Synonyms (1Z)-3-heptyl-2-(phenylselanyl)-1-undecenyl 4-methylphenyl sulfone 1-{[(1Z)-3-heptyl-2-(phenylselanyl)-1-undecenyl]sulfonyl}-4-methylbenzene Z-2-(phenylseleno)-1-(p-tolylsulfonyl)-3-heptyl-2-undecene
Wiley ID 1406934