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(2'E)-2,5-bis(3',7'-dimethyloctadienyl)-3-methyl-2,5-dihydrothiophen 1,1-dioxide
SpectraBase Compound ID 3WGY79MDzk2
InChI InChI=1S/C25H40O2S/c1-19(2)10-8-12-21(5)14-16-24-18-23(7)25(28(24,26)27)17-15-22(6)13-9-11-20(3)4/h10-11,14-15,18,24-25H,8-9,12-13,16-17H2,1-7H3/b21-14+,22-15+
InChIKey RYGKZZGSIRXSOB-NNFYUIBOSA-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 B3rsAD9bOoy
Name (2'E)-2,5-bis(3',7'-dimethyloctadienyl)-3-methyl-2,5-dihydrothiophen 1,1-dioxide
Alternate Name(s) 2,5-bis[(2E)-3,7-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/c1-19(2)10-8-12-21(5)14-16-24-18-23(7)25(28(24,26)27)17-15-22(6)13-9-11-20(3)4/h10-11,14-15,18,24-25H,8-9,12-13,16-17H2,1-7H3/b21-14+,22-15+
InChIKey RYGKZZGSIRXSOB-NNFYUIBOSA-N
Molecular Weight 404.653 g/mol
SMILES C1(S(C(C=C1C)C\C=C\(CCC=C(C)C)C)(=O)=O)C\C=C\(CCC=C(C)C)C
SPLASH splash10-05nf-9200000000-a5e4630cf8c4f40422a6
Source of Spectrum B-46-1929-0
Wiley ID 1371496