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.psi.,.psi.-Carotene, 3,4-didehydro-1,2,7',8'-tetrahydro-1-methoxy-2-oxo-
SpectraBase Compound ID DYzgqI9KDDp
InChI InChI=1S/C41H58O2/c1-33(2)19-14-22-36(5)25-17-28-37(6)26-15-23-34(3)20-12-13-21-35(4)24-16-27-38(7)29-18-30-39(8)31-32-40(42)41(9,10)43-11/h12-13,15-16,18-21,23-27,29-32H,14,17,22,28H2,1-11H3/b13-12+,23-15+,24-16+,29-18+,32-31+,34-20+,35-21+,36-25+,37-26+,38-27+,39-30+
InChIKey ZQFURSYWJPLAJR-FZFXUSNISA-N
Mol Weight 582.9 g/mol
Molecular Formula C41H58O2
Exact Mass 582.443681 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2weJ7GqvInA
Name .psi.,.psi.-Carotene, 3,4-didehydro-1,2,7',8'-tetrahydro-1-methoxy-2-oxo-
Alternate Name(s) (3E)-3,4-Didehydro-1,2,7',8'-tetrahydro-psi,psi-carotene (4E,6E,8E,10E,12E,14E,16E,18E,20E,22E,26E)-2-methoxy-2,6,10,14,19,23,27,31-octamethyl-3-dotriaconta-4,6,8,10,12,14,16,18,20,22,26,30-dodecaenone (4E,6E,8E,10E,12E,14E,16E,18E,20E,22E,26E)-2-methoxy-2,6,10,14,19,23,27,31-octamethyl-dotriaconta-4,6,8,10,12,14,16,18,20,22,26,30-dodecaen-3-one Lycopene, 3,4-didehydro-1,2,7',8'-tetrahydro-1-methoxy-2-oxo-, all-trans- Pigment R psi,psi-carotene, 3,4-didehydro-1,2,7',8-tetrahydro-1-methoxy-2-oxo- Spherodenon Spheroidenone Spheroidenone, all-trans-
CAS Registry Number 13836-70-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C41H58O2
InChI InChI=1S/C41H58O2/c1-33(2)19-14-22-36(5)25-17-28-37(6)26-15-23-34(3)20-12-13-21-35(4)24-16-27-38(7)29-18-30-39(8)31-32-40(42)41(9,10)43-11/h12-13,15-16,18-21,23-27,29-32H,14,17,22,28H2,1-11H3/b13-12+,23-15+,24-16+,29-18+,32-31+,34-20+,35-21+,36-25+,37-26+,38-27+,39-30+
InChIKey ZQFURSYWJPLAJR-FZFXUSNISA-N
Molecular Weight 582.913 g/mol
SMILES COC(C)(C)C(=O)\C=C\C(C)=C\C=C\C(C)=C\C=C\C(C)=C\C=C\C=C/(C)\C=C\C=C/(C)CC\C=C/(C)CCC=C(C)C
SPLASH splash10-00di-9620100000-1e4b268915113ff701aa
Source of Spectrum EP-2340-0-0
Wiley ID 1408724