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(Z)-25,26-bis(methylsulfanyl)hentriacont-6-ene
SpectraBase Compound ID EPPi0zlXqvx
InChI InChI=1S/C33H66S2/c1-5-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-29-31-33(35-4)32(34-3)30-28-8-6-2/h11-12,32-33H,5-10,13-31H2,1-4H3/b12-11-
InChIKey LPHINKJGQYUVPT-QXMHVHEDSA-N
Mol Weight 527.0 g/mol
Molecular Formula C33H66S2
Exact Mass 526.460594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3siPmrYsaJu
Name (Z)-25,26-bis(methylsulfanyl)hentriacont-6-ene
Carrier Gas Helium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H66S2
GC Oven Program Oven temp 320oC, Splitless injector
InChI InChI=1S/C33H66S2/c1-5-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-29-31-33(35-4)32(34-3)30-28-8-6-2/h11-12,32-33H,5-10,13-31H2,1-4H3/b12-11-
InChIKey LPHINKJGQYUVPT-QXMHVHEDSA-N
Instrument Name Agilent 6890-5973
Ionization Type EI
Literature Reference DOI 10.1002/rcm.9228
Molecular Weight 527.011 g/mol
SMILES C(CCCC(C(SC)CCCCCCCCCCCCCCCCC\C=C/CCCCC)SC)C
SPLASH splash10-001i-9202400000-e1ef11f0d70845844fb5
Source of Spectrum RCM-36-8-Fig 5A-4
Wiley ID 1879655