| SpectraBase Compound ID | EoD6rTJY5h4 |
|---|---|
| InChI | InChI=1S/C42H56O4/c1-33(21-15-23-35(3)25-17-27-37(5)29-31-39(43)41(7,8)45-11)19-13-14-20-34(2)22-16-24-36(4)26-18-28-38(6)30-32-40(44)42(9,10)46-12/h13-32H,1-12H3/b14-13+,21-15+,22-16+,25-17+,26-18+,31-29+,32-30+,33-19+,34-20+,35-23+,36-24+,37-27+,38-28+ |
| InChIKey | MNKGOUOMGDXWPK-YDDLGYPNSA-N |
| Mol Weight | 624.9 g/mol |
| Molecular Formula | C42H56O4 |
| Exact Mass | 624.41786 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Be0KTEb8XIp |
|---|---|
| Name | .psi.,.psi.-Carotene, 3,3',4,4'-tetradehydro-1,1',2,2'-tetrahydro-1,1'-dimethoxy-2,2'-dioxo- |
| Alternate Name(s) | (4E,6E,8E,10E,12E,14E,16E,18E,20E,22E,24E,26E,28E)-2,31-dimethoxy-2,6,10,14,19,23,27,31-octamethyl-dotriaconta-4,6,8,10,12,14,16,18,20,22,24,26,28-tridecaene-3,30-dione 2,2'-Diketospirilloxanthin 2,2'-Dioxospirilloxanthin Lycopene, 3,3',4,4'-tetradehydro-1,1',2,2'-tetrahydro-1,1'-dimethoxy-2,2'-dioxo-, all-trans- PE-518 Rhodoviolascin-2,2'-dione P 518 |
| CAS Registry Number | 1185-31-5 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C42H56O4 |
| InChI | InChI=1S/C42H56O4/c1-33(21-15-23-35(3)25-17-27-37(5)29-31-39(43)41(7,8)45-11)19-13-14-20-34(2)22-16-24-36(4)26-18-28-38(6)30-32-40(44)42(9,10)46-12/h13-32H,1-12H3/b14-13+,21-15+,22-16+,25-17+,26-18+,31-29+,32-30+,33-19+,34-20+,35-23+,36-24+,37-27+,38-28+ |
| InChIKey | MNKGOUOMGDXWPK-YDDLGYPNSA-N |
| Molecular Weight | 624.906 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)\C=C\C=C/(C)\C=C\C(=O)C(C)(C)OC |
| SPLASH | splash10-00dl-9310000000-186866484093dff4c8f8 |
| Source of Spectrum | EP-2347-0-0 |
| Wiley ID | 1411810 |