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2-(Phenylseleno)-1-(p-toluenesulfonyl)-octene
SpectraBase Compound ID Crb6az0cqKk
InChI InChI=1S/C21H26O2SSe/c1-3-4-5-7-12-21(25-20-10-8-6-9-11-20)17-24(22,23)19-15-13-18(2)14-16-19/h6,8-11,13-17H,3-5,7,12H2,1-2H3/b21-17-
InChIKey ZDUBYBHKTKONHA-FXBPSFAMSA-N
Mol Weight 421.47 g/mol
Molecular Formula C21H26O2SSe
Exact Mass 422.081873 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 18pyDRcmSO
Name 2-(Phenylseleno)-1-(p-toluenesulfonyl)-octene
Alternate Name(s) 1-Methyl-4-{[(1Z)-2-(phenylselanyl)-1-octenyl]sulfonyl}benzene 2-(Phenylseleno)-1-[(p-tolyl)sulfonyl]-octene 4-Methylphenyl (1Z)-2-(phenylselanyl)-1-octenyl sulfone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26O2SSe
InChI InChI=1S/C21H26O2SSe/c1-3-4-5-7-12-21(25-20-10-8-6-9-11-20)17-24(22,23)19-15-13-18(2)14-16-19/h6,8-11,13-17H,3-5,7,12H2,1-2H3/b21-17-
InChIKey ZDUBYBHKTKONHA-FXBPSFAMSA-N
Molecular Weight 421.469 g/mol
SMILES c1([Se]\C(=C/S(c2ccc(cc2)C)(=O)=O)CCCCCC)ccccc1
SPLASH splash10-0a4i-4900000000-b3974a07519f0628b0e4
Source of Spectrum SK-32-1248-2
Wiley ID 1548722