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.chi.,.chi.-Caroten-20-ol
SpectraBase Compound ID J9LT3aYOnqU
InChI InChI=1S/C40H48O/c1-29(15-12-16-30(2)20-24-39-26-22-32(4)34(6)36(39)8)14-10-11-18-38(28-41)19-13-17-31(3)21-25-40-27-23-33(5)35(7)37(40)9/h10-27,41H,28H2,1-9H3/b11-10+,15-12+,19-13+,24-20+,25-21+,29-14+,30-16+,31-17+,38-18-
InChIKey PVKHPFZSRCXXAO-BCUDNLAOSA-N
Mol Weight 544.8 g/mol
Molecular Formula C40H48O
Exact Mass 544.370516 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K1qzZWRGCsv
Name .chi.,.chi.-Caroten-20-ol
CAS Registry Number 64397-65-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C40H48O
InChI InChI=1S/C40H48O/c1-29(15-12-16-30(2)20-24-39-26-22-32(4)34(6)36(39)8)14-10-11-18-38(28-41)19-13-17-31(3)21-25-40-27-23-33(5)35(7)37(40)9/h10-27,41H,28H2,1-9H3/b11-10+,15-12+,19-13+,24-20+,25-21+,29-14+,30-16+,31-17+,38-18-
InChIKey PVKHPFZSRCXXAO-BCUDNLAOSA-N
Molecular Weight 544.823 g/mol
SMILES OC\C(\C=C\C=C\(\C=C\c1c(c(c(C)cc1)C)C)C)=C/C=C/C=C/(\C=C\C=C\(\C=C\c1c(c(C)c(cc1)C)C)C)C
SPLASH splash10-001l-0900080000-9acfc1e2a9905dd0b834
Source of Spectrum F-33-382-0
Synonyms Chi,chi-caroten-20-ol Renierapurpurin-20-ol
Wiley ID 1405131