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trans-8'-APO-beta-CAROTENOIC ACID, ETHYL ESTER
SpectraBase Compound ID IhDkhbciQCO
InChI InChI=1S/C32H44O2/c1-9-34-31(33)29(6)20-13-19-26(3)16-11-10-15-25(2)17-12-18-27(4)22-23-30-28(5)21-14-24-32(30,7)8/h10-13,15-20,22-23H,9,14,21,24H2,1-8H3/b11-10+,17-12+,19-13+,23-22+,25-15+,26-16+,27-18+,29-20+
InChIKey GIRXTOSJOKKBHO-BQTUIHPCSA-N
Mol Weight 460.7 g/mol
Molecular Formula C32H44O2
Exact Mass 460.334131 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2s87Av0iH4y
Name trans-8'-APO-beta-CAROTENOIC ACID, ETHYL ESTER
Source of Sample Fluka AG, Buchs, Switzerland
CAS Registry Number 1109-11-1
Comments Some carbon atoms are unassigned
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H44O2
InChI InChI=1S/C32H44O2/c1-9-34-31(33)29(6)20-13-19-26(3)16-11-10-15-25(2)17-12-18-27(4)22-23-30-28(5)21-14-24-32(30,7)8/h10-13,15-20,22-23H,9,14,21,24H2,1-8H3/b11-10+,17-12+,19-13+,23-22+,25-15+,26-16+,27-18+,29-20+
InChIKey GIRXTOSJOKKBHO-BQTUIHPCSA-N
Melting Point 134-136C
Molecular Weight 460.71
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms 8'-APO-B-CAROTENOIC ACID, ETHYL ESTER, trans-,