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(6Z,25Z)-9,10-bis(methylsulfanyl)hentriaconta-6,25-diene
SpectraBase Compound ID 4F2mfObAwKK
InChI InChI=1S/C33H64S2/c1-5-7-9-11-13-14-15-16-17-18-19-20-21-22-23-24-25-27-29-31-33(35-4)32(34-3)30-28-26-12-10-8-6-2/h13-14,26,28,32-33H,5-12,15-25,27,29-31H2,1-4H3/b14-13-,28-26-
InChIKey VBKJSKOTLXZZNC-GMQDECQQSA-N
Mol Weight 525.0 g/mol
Molecular Formula C33H64S2
Exact Mass 524.444944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AoytXoEPocc
Name (6Z,25Z)-9,10-bis(methylsulfanyl)hentriaconta-6,25-diene
Carrier Gas Helium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H64S2
GC Oven Program Oven temp 320oC, Splitless injector
InChI InChI=1S/C33H64S2/c1-5-7-9-11-13-14-15-16-17-18-19-20-21-22-23-24-25-27-29-31-33(35-4)32(34-3)30-28-26-12-10-8-6-2/h13-14,26,28,32-33H,5-12,15-25,27,29-31H2,1-4H3/b14-13-,28-26-
InChIKey VBKJSKOTLXZZNC-GMQDECQQSA-N
Instrument Name Agilent 6890-5973
Ionization Type EI
Literature Reference DOI 10.1002/rcm.9228
Molecular Weight 524.995 g/mol
SMILES CCCCC\C=C/CC(C(CCCCCCCCCCCCCC\C=C/CCCCC)SC)SC
SPLASH splash10-05q9-9301200000-add34dd7683a6e7736f5
Source of Spectrum RCM-36-8-Fig 5C-2
Wiley ID 1879657