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(6E,8E,10E,12E,14E,16E,18E,20E,22E,26E)-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,8,10,12,14,16,18,20,22,26,30-dodecaene

View entire compound with spectra: 2 MS (GC)

(6E,8E,10E,12E,14E,16E,18E,20E,22E,26E)-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,8,10,12,14,16,18,20,22,26,30-dodecaene
SpectraBase Compound ID 6VbU241Pd09
InChI InChI=1S/C40H58/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/h11-12,15-17,19-22,25-31H,13-14,18,23-24,32H2,1-10H3/b12-11+,25-15+,26-16+,31-17+,35-21+,36-22+,37-27+,38-28+,39-29+,40-30+
InChIKey ATCICVFRSJQYDV-XILUKMICSA-N
Mol Weight 538.9 g/mol
Molecular Formula C40H58
Exact Mass 538.453852 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G45s2k0BQuS
Name (6E,8E,10E,12E,14E,16E,18E,20E,22E,26E)-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,8,10,12,14,16,18,20,22,26,30-dodecaene
CAS Registry Number 86087-07-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C40H58
InChI InChI=1S/C40H58/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/h11-12,15-17,19-22,25-31H,13-14,18,23-24,32H2,1-10H3/b12-11+,25-15+,26-16+,31-17+,35-21+,36-22+,37-27+,38-28+,39-29+,40-30+
InChIKey ATCICVFRSJQYDV-XILUKMICSA-N
Molecular Weight 538.904 g/mol
SMILES C(\C(=C\C=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)CC=C(C)C
SPLASH splash10-014l-9000010000-1fddf11944bb8891866d
Source of Spectrum H-68-1537-9
Synonyms (5z)-neurosporin (5z)-7,8-dihydro-.psi.,.psi.-carotin (all-E)-7,8-dihydro-.psi.,.psi.-carotin (all-E)-neurosporin
Wiley ID 1404432