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(2E,6E,10E)-3,7,11,15-Tetramethyl-9-phenylsulfonyl-2,6,10,14-tetraen-1-hexadecanol
SpectraBase Compound ID LHpVqjtAFC1
InChI InChI=1S/C26H38O3S/c1-21(2)11-9-13-23(4)19-26(30(28,29)25-15-7-6-8-16-25)20-24(5)14-10-12-22(3)17-18-27/h6-8,11,14-17,19,26-27H,9-10,12-13,18,20H2,1-5H3/b22-17+,23-19+,24-14+
InChIKey HNPJPROQZUQIMX-DUSBOPHJSA-N
Mol Weight 430.6 g/mol
Molecular Formula C26H38O3S
Exact Mass 430.254166 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 29bpbPeWziZ
Name (2E,6E,10E)-3,7,11,15-Tetramethyl-9-phenylsulfonyl-2,6,10,14-tetraen-1-hexadecanol
Alternate Name(s) (2E,6E,10E)-3,7,11,15-tetramethyl-9-(phenylsulfonyl)hexadeca-2,6,10,14-tetraen-1-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H38O3S
InChI InChI=1S/C26H38O3S/c1-21(2)11-9-13-23(4)19-26(30(28,29)25-15-7-6-8-16-25)20-24(5)14-10-12-22(3)17-18-27/h6-8,11,14-17,19,26-27H,9-10,12-13,18,20H2,1-5H3/b22-17+,23-19+,24-14+
InChIKey HNPJPROQZUQIMX-DUSBOPHJSA-N
Literature Reference DOI 10.1002/cjoc.19940120412
Molecular Weight 430.647 g/mol
SMILES OC\C=C/(C)CC\C=C/(C)CC(\C=C\(CCC=C(C)C)C)S(c1ccccc1)(=O)=O
SPLASH splash10-014i-9230000000-570bddb0b545d81426bd
Source of Spectrum CJC-12-376-1
Wiley ID 1801032