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Benzene, 1-methyl-4-[[2-methyl-5-(phenylseleno)-2-pentenyl]sulfonyl]-, (E)-
SpectraBase Compound ID 84kczivY0Pg
InChI InChI=1S/C19H22O2SSe/c1-16-10-12-18(13-11-16)22(20,21)15-17(2)7-6-14-23-19-8-4-3-5-9-19/h3-5,7-13H,6,14-15H2,1-2H3/b17-7+
InChIKey YXNAGOPQDFVEAT-REZTVBANSA-N
Mol Weight 393.41 g/mol
Molecular Formula C19H22O2SSe
Exact Mass 394.050573 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BQTvbiGII4I
Name Benzene, 1-methyl-4-[[2-methyl-5-(phenylseleno)-2-pentenyl]sulfonyl]-, (E)-
Alternate Name(s) 1-Methyl-4-{[(2E)-2-methyl-5-(phenylselanyl)-2-pentenyl]sulfonyl}benzene 4-Methylphenyl (2E)-2-methyl-5-(phenylselanyl)-2-pentenyl sulfone
CAS Registry Number 117734-73-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22O2SSe
InChI InChI=1S/C19H22O2SSe/c1-16-10-12-18(13-11-16)22(20,21)15-17(2)7-6-14-23-19-8-4-3-5-9-19/h3-5,7-13H,6,14-15H2,1-2H3/b17-7+
InChIKey YXNAGOPQDFVEAT-REZTVBANSA-N
Molecular Weight 393.415 g/mol
SMILES c1(S(C\C(=C\CC[Se]c2ccccc2)C)(=O)=O)ccc(cc1)C
SPLASH splash10-001u-9031000000-54484fdc501359cfa52a
Source of Spectrum J-54-124-0
Wiley ID 1366531