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(3Z,6Z,9Z,12Z,15Z)-1-[[(3Z,6Z,9Z,12Z,15Z)-octadeca-3,6,9,12,15-pentaenyl]disulfanyl]octadeca-3,6,9,12,15-pentaene
SpectraBase Compound ID CVdtURjBkBt
InChI InChI=1S/C36H54S2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,23-26,29-32H,3-4,9-10,15-16,21-22,27-28,33-36H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-,25-23-,26-24-,31-29-,32-30-
InChIKey PPSLFPLDFMVREB-LPEZNXMBSA-N
Mol Weight 550.9 g/mol
Molecular Formula C36H54S2
Exact Mass 550.366694 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7rXkCoII7Sd
Name (3Z,6Z,9Z,12Z,15Z)-1-[[(3Z,6Z,9Z,12Z,15Z)-octadeca-3,6,9,12,15-pentaenyl]disulfanyl]octadeca-3,6,9,12,15-pentaene
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H54S2
InChI InChI=1S/C36H54S2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,23-26,29-32H,3-4,9-10,15-16,21-22,27-28,33-36H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-,25-23-,26-24-,31-29-,32-30-
InChIKey PPSLFPLDFMVREB-LPEZNXMBSA-N
Molecular Weight 550.948 g/mol
SMILES C(\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CC)CSSCC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CC
SPLASH splash10-004i-9000000000-83c7257d4d6f900b5640
Source of Spectrum KC-0-2274-0
Wiley ID 831276