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.beta.,.Epsilon.-caroten-4-one, 3,3'-bis(acetyloxy)-2,3-didehydro-, -
SpectraBase Compound ID LcH3FqGRtns
InChI InChI=1S/C44H56O5/c1-30(20-15-22-32(3)25-27-38-34(5)24-17-29-43(38,9)10)18-13-14-19-31(2)21-16-23-33(4)26-28-39-35(6)40(47)41(48-36(7)45)42(44(39,11)12)49-37(8)46/h13-16,18-28,38H,17,29H2,1-12H3/b14-13+,20-15+,21-16+,27-25+,28-26+,30-18+,31-19+,32-22+,33-23+
InChIKey GUJMVEHJNASJHY-XDQCTFIRSA-N
Mol Weight 664.9 g/mol
Molecular Formula C44H56O5
Exact Mass 664.412775 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IXygArxphTj
Name .beta.,.epsilon.-Caroten-4-one, 3,3'-bis(acetyloxy)-2,3-didehydro-, -
CAS Registry Number 68420-67-7
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C44H56O5
InChI InChI=1S/C44H56O5/c1-30(20-15-22-32(3)25-27-38-34(5)24-17-29-43(38,9)10)18-13-14-19-31(2)21-16-23-33(4)26-28-39-35(6)40(47)41(48-36(7)45)42(44(39,11)12)49-37(8)46/h13-16,18-28,38H,17,29H2,1-12H3/b14-13+,20-15+,21-16+,27-25+,28-26+,30-18+,31-19+,32-22+,33-23+
InChIKey GUJMVEHJNASJHY-XDQCTFIRSA-N
Molecular Weight 664.927 g/mol
SMILES C1(=C(C(C)(C)C(=C(C1=O)C)\C=C\C(=C\C=C\C(=C\C=C\C=C\(\C=C\C=C\(\C=C\C1C(=CCCC1(C)C)C)C)C)C)C)OC(=O)C)OC(=O)C
SPLASH splash10-0j4i-0000019000-461aa2adc90f0f897e3d
Source of Spectrum H-61-1966-0
Synonyms 2,3-Didehydrofritschiellaxanthin-diacetate 2-(acetyloxy)-3,3,5-trimethyl-6-oxo-4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethyl-2-cyclohexen-1-yl)-1,3,5,7,9,11,13,15,17-octadecanonaenyl]-1,4-cyclohexadien-1-yl acetate
Wiley ID 1413718