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(2'E)-2,2-bis(3',7'-dimethylocta-2',6'-dienyl)-3-methyl-2,5-dihydrothiophen 1,1-dioxide
SpectraBase Compound ID 8P1jEJK2nAX
InChI InChI=1S/C25H40O2S/c1-8-20(3)10-12-22(5)14-17-25(24(7)16-19-28(25,26)27)18-15-23(6)13-11-21(4)9-2/h8-9,14-16H,10-13,17-19H2,1-7H3/b20-8+,21-9+,22-14+,23-15+
InChIKey PNAGSPKEGPQFTM-KIDSFUBDSA-N
Mol Weight 404.7 g/mol
Molecular Formula C25H40O2S
Exact Mass 404.274902 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GHPmVUZIOk4
Name (2'E)-2,2-bis(3',7'-dimethylocta-2',6'-dienyl)-3-methyl-2,5-dihydrothiophen 1,1-dioxide
Alternate Name(s) 2,2-bis[(2E,6E)-3,6-dimethyl-2,6-octadienyl]-3-methyl-2,5-dihydrothiophene 1,1-dioxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H40O2S
InChI InChI=1S/C25H40O2S/c1-8-20(3)10-12-22(5)14-17-25(24(7)16-19-28(25,26)27)18-15-23(6)13-11-21(4)9-2/h8-9,14-16H,10-13,17-19H2,1-7H3/b20-8+,21-9+,22-14+,23-15+
InChIKey PNAGSPKEGPQFTM-KIDSFUBDSA-N
Molecular Weight 404.653 g/mol
SMILES C1(S(CC=C1C)(=O)=O)(C\C=C\(CC\C(=C\C)C)C)C\C=C\(CC\C(=C\C)C)C
SPLASH splash10-014l-9100000000-26a13d19e2fb95aac650
Source of Spectrum B-46-1929-0
Wiley ID 1371495