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15,15'-Dihydro-.beta.,.beta-Carotene

View entire compound with spectra: 1 MS (GC)

15,15'-Dihydro-.beta.,.beta-Carotene
SpectraBase Compound ID 251pAxR3u7I
InChI InChI=1S/C40H58/c1-31(19-13-21-33(3)25-27-37-35(5)23-15-29-39(37,7)8)17-11-12-18-32(2)20-14-22-34(4)26-28-38-36(6)24-16-30-40(38,9)10/h13-14,17-22,25-28H,11-12,15-16,23-24,29-30H2,1-10H3/b19-13+,20-14+,27-25+,28-26+,31-17+,32-18+,33-21+,34-22+
InChIKey MZFUCCXRKZISLZ-AYPYYXBOSA-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 JUYQAy6ne2b
Name 15,15'-Dihydro-.beta.,.beta-Carotene
Alternate Name(s) 15,15'-Dihydro-.beta.,..beta.-Carotene 1,3,3-trimethyl-2-[(1E,3E,5E,7E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethyl-1-cyclohexenyl)octadeca-1,3,5,7,11,13,15,17-octaenyl]cyclohexene
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Formula C40H58
InChI InChI=1S/C40H58/c1-31(19-13-21-33(3)25-27-37-35(5)23-15-29-39(37,7)8)17-11-12-18-32(2)20-14-22-34(4)26-28-38-36(6)24-16-30-40(38,9)10/h13-14,17-22,25-28H,11-12,15-16,23-24,29-30H2,1-10H3/b19-13+,20-14+,27-25+,28-26+,31-17+,32-18+,33-21+,34-22+
InChIKey MZFUCCXRKZISLZ-AYPYYXBOSA-N
Molecular Weight 538.904 g/mol
SMILES C1(\C=C\C(=C\C=C\C(=C\CC\C=C\(\C=C\C=C\(\C=C\C2=C(CCCC2(C)C)C)C)C)C)C)=C(CCCC1(C)C)C
SPLASH splash10-014i-4190000000-fd92698f5a83d2ef9461
Source of Spectrum H-84-2315-15
Wiley ID 847689