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(6E,10Z,12E,14E,16E,18E,20E,22Z,26E)-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,10,12,14,16,18,20,22,26,30-undecaene

View entire compound with spectra: 1 MS (GC)

(6E,10Z,12E,14E,16E,18E,20E,22Z,26E)-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,10,12,14,16,18,20,22,26,30-undecaene
SpectraBase Compound ID 52ApGeIZ1La
InChI InChI=1S/C40H60/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,15-16,19-22,25-30H,13-14,17-18,23-24,31-32H2,1-10H3/b12-11+,25-15+,26-16+,35-21+,36-22+,37-27+,38-28+,39-29-,40-30-
InChIKey BIWLELKAFXRPDE-ZURBLSRNSA-N
Mol Weight 540.9 g/mol
Molecular Formula C40H60
Exact Mass 540.469502 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FcbXH462xf0
Name (6E,10Z,12E,14E,16E,18E,20E,22Z,26E)-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,10,12,14,16,18,20,22,26,30-undecaene
Alternate Name(s) psi,psi-carotene, 7,7',8,8'-tetrahydro-, (9-cis,9'-cis)-
CAS Registry Number 72746-33-9
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C40H60
InChI InChI=1S/C40H60/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,15-16,19-22,25-30H,13-14,17-18,23-24,31-32H2,1-10H3/b12-11+,25-15+,26-16+,35-21+,36-22+,37-27+,38-28+,39-29-,40-30-
InChIKey BIWLELKAFXRPDE-ZURBLSRNSA-N
Molecular Weight 540.920 g/mol
SMILES C(\C(=C/C=C/C(=C/C=C/C=C/(\C=C\C=C/(CC\C=C\(CCC=C(C)C)C)C)C)C)C)C\C=C\(CCC=C(C)C)C
SPLASH splash10-0006-0000090000-d4ca9c617d4de530b6f0
Source of Spectrum KC-1983-3018-0
Wiley ID 1404709