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(E,E,E)-14,14-Ethylenedioxy-3,7,11,15-tetramethyl-1-(phenylthio)-2,6,10-hexadecatriene
SpectraBase Compound ID EI6Krqtrz9U
InChI InChI=1S/C28H42O2S/c1-23(2)28(29-20-21-30-28)19-17-25(4)13-9-11-24(3)12-10-14-26(5)18-22-31-27-15-7-6-8-16-27/h6-8,12-13,15-16,18,23H,9-11,14,17,19-22H2,1-5H3/b24-12+,25-13+,26-18+
InChIKey KMZLKZVXFKPZHK-NOKXSPIGSA-N
Mol Weight 442.7 g/mol
Molecular Formula C28H42O2S
Exact Mass 442.290552 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HLc7vp0Zama
Name (E,E,E)-14,14-Ethylenedioxy-3,7,11,15-tetramethyl-1-(phenylthio)-2,6,10-hexadecatriene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H42O2S
InChI InChI=1S/C28H42O2S/c1-23(2)28(29-20-21-30-28)19-17-25(4)13-9-11-24(3)12-10-14-26(5)18-22-31-27-15-7-6-8-16-27/h6-8,12-13,15-16,18,23H,9-11,14,17,19-22H2,1-5H3/b24-12+,25-13+,26-18+
InChIKey KMZLKZVXFKPZHK-NOKXSPIGSA-N
Molecular Weight 442.702 g/mol
SMILES C1(OCCO1)(CC\C(=C\CC\C(=C\CC\C(=C\CSc1ccccc1)C)C)C)C(C)C
SPLASH splash10-0079-9071000000-d633241dc0f0bd5d6186
Source of Spectrum AT-34-2800-4
Synonyms 1-Phenylthio-3,7,11,15-tetramethyl-14-(ethylenedioxy)hexadeca-2,6,10-triene (2E,6E,10E)-13-(2-isopropyl-1,3-dioxolan-2-yl)-3,7,11-trimethyl-2,6,10-tridecatrienyl phenyl sulfide 2-isopropyl-2-[(3E,7E,11E)-3,7,11-trimethyl-13-(phenylsulfanyl)-3,7,11-tridecatrienyl]-1,3-dioxolane
Wiley ID 852446