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Benzene, 1-[[2-chloro-5-(phenylseleno)-2-pentenyl]sulfonyl]-4-methyl-, (E)-
SpectraBase Compound ID EHoCIQiYQ1
InChI InChI=1S/C18H19ClO2SSe/c1-15-9-11-17(12-10-15)22(20,21)14-16(19)6-5-13-23-18-7-3-2-4-8-18/h2-4,6-12H,5,13-14H2,1H3/b16-6+
InChIKey JBKUYNHBDQKJHT-OMCISZLKSA-N
Mol Weight 413.83 g/mol
Molecular Formula C18H19ClO2SSe
Exact Mass 413.995951 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4x55dEXDqML
Name Benzene, 1-[[2-chloro-5-(phenylseleno)-2-pentenyl]sulfonyl]-4-methyl-, (E)-
Alternate Name(s) (2E)-2-chloro-5-(phenylselanyl)-2-pentenyl 4-methylphenyl sulfone 1-{[(2E)-2-chloro-5-(phenylselanyl)-2-pentenyl]sulfonyl}-4-methylbenzene
CAS Registry Number 117734-75-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H19ClO2SSe
InChI InChI=1S/C18H19ClO2SSe/c1-15-9-11-17(12-10-15)22(20,21)14-16(19)6-5-13-23-18-7-3-2-4-8-18/h2-4,6-12H,5,13-14H2,1H3/b16-6+
InChIKey JBKUYNHBDQKJHT-OMCISZLKSA-N
Molecular Weight 413.833 g/mol
SMILES C(S(c1ccc(cc1)C)(=O)=O)\C(=C/CC[Se]c1ccccc1)Cl
SPLASH splash10-0006-9000000000-85e87189ed73c38473a3
Source of Spectrum J-54-124-0
Wiley ID 1375192