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(+/-)-4-[(4-methylphenyl)sulfonyl]-5,7-nonadien-1-ol
SpectraBase Compound ID AuN2XYwXDds
InChI InChI=1S/C16H22O3S/c1-3-4-5-7-15(8-6-13-17)20(18,19)16-11-9-14(2)10-12-16/h3-5,7,9-12,15,17H,6,8,13H2,1-2H3/b4-3+,7-5-
InChIKey VRSCXZBWIVWYNB-BZDQXIRASA-N
Mol Weight 294.41 g/mol
Molecular Formula C16H22O3S
Exact Mass 294.128966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gb9z7gBVYyL
Name (+/-)-4-[(4-methylphenyl)sulfonyl]-5,7-nonadien-1-ol
Alternate Name(s) (5Z,7E)-4-[(4-methylphenyl)sulfonyl]-5,7-nonadien-1-ol
CAS Registry Number 96556-56-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O3S
InChI InChI=1S/C16H22O3S/c1-3-4-5-7-15(8-6-13-17)20(18,19)16-11-9-14(2)10-12-16/h3-5,7,9-12,15,17H,6,8,13H2,1-2H3/b4-3+,7-5-
InChIKey VRSCXZBWIVWYNB-BZDQXIRASA-N
Molecular Weight 294.409 g/mol
SMILES OCCCC(S(c1ccc(cc1)C)(=O)=O)\C=C/C=C/C
SPLASH splash10-0006-7910000000-61861b5fab59e24897d4
Source of Spectrum J-50-2630-14
Wiley ID 1297100