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1-(Ethylenedioxy)-6-(benzenesulfonyl)-4,9,13,17-tetramethyl-4(E),8(E),12(E),16-octadecatetraene
SpectraBase Compound ID BPLr0A6f1Yl
InChI InChI=1S/C30H44O4S/c1-24(2)12-9-13-25(3)14-10-15-26(4)22-29(35(31,32)28-17-7-6-8-18-28)23-27(5)16-11-19-30-33-20-21-34-30/h6-8,12,14,16-18,22,29-30H,9-11,13,15,19-21,23H2,1-5H3/b25-14+,26-22+,27-16+
InChIKey KVUOMCKFRDFGIO-AJLXIQBBSA-N
Mol Weight 500.7 g/mol
Molecular Formula C30H44O4S
Exact Mass 500.296031 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2nku2WzO8Z9
Name 1-(Ethylenedioxy)-6-(benzenesulfonyl)-4,9,13,17-tetramethyl-4(E),8(E),12(E),16-octadecatetraene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H44O4S
InChI InChI=1S/C30H44O4S/c1-24(2)12-9-13-25(3)14-10-15-26(4)22-29(35(31,32)28-17-7-6-8-18-28)23-27(5)16-11-19-30-33-20-21-34-30/h6-8,12,14,16-18,22,29-30H,9-11,13,15,19-21,23H2,1-5H3/b25-14+,26-22+,27-16+
InChIKey KVUOMCKFRDFGIO-AJLXIQBBSA-N
Molecular Weight 500.738 g/mol
SMILES C(S(=O)(=O)c1ccccc1)(\C=C\(CC\C=C\(CCC=C(C)C)C)C)C\C(=C\CCC1OCCO1)C
SPLASH splash10-01c0-9400000000-88a0ccd3bf15c7e53f2a
Source of Spectrum J-57-7232-25
Synonyms (2E,6E)-1-[(2E)-5-(1,3-dioxolan-2-yl)-2-methyl-2-pentenyl]-3,7,11-trimethyl-2,6,10-dodecatrienyl phenyl sulfone 2-[(3E,7E,11E)-4,8,12,16-tetramethyl-6-(phenylsulfonyl)-3,7,11,15-heptadecatetraenyl]-1,3-dioxolane
Wiley ID 1398915