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((2E,6E)-3,7,11-Trimethyldodeca-2,6,10-trien-1-yl)(octyl)sulfane
SpectraBase Compound ID E4eIQR0ynXi
InChI InChI=1S/C23H42S/c1-6-7-8-9-10-11-19-24-20-18-23(5)17-13-16-22(4)15-12-14-21(2)3/h14,16,18H,6-13,15,17,19-20H2,1-5H3/b22-16+,23-18+
InChIKey OBICLDMSBRXHHW-NERIYXGDSA-N
Mol Weight 350.6 g/mol
Molecular Formula C23H42S
Exact Mass 350.300723 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CtcgiB2bhl7
Name ((2E,6E)-3,7,11-Trimethyldodeca-2,6,10-trien-1-yl)(octyl)sulfane
Appearance Yellow oil
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Formula C23H42S
InChI InChI=1S/C23H42S/c1-6-7-8-9-10-11-19-24-20-18-23(5)17-13-16-22(4)15-12-14-21(2)3/h14,16,18H,6-13,15,17,19-20H2,1-5H3/b22-16+,23-18+
InChIKey OBICLDMSBRXHHW-NERIYXGDSA-N
Instrument Name Agilent Technologies 7890A-5975C
Ionization Type EI
Literature Reference DOI 10.1002/adsc.201901250
Molecular Weight 350.649 g/mol
Reported Formula C23H42S
SMILES C\C(CC\C=C/(C)CCC=C(C)C)=C/CSCCCCCCCC
SPLASH splash10-014l-9100000000-608934b6f30ac37415f0
Source of Spectrum ASC-362-SM25-3ac
Thin-Layer Chromatography Rf = 0.20 (cyclohexane, CAM)
Wiley ID 1838136