| SpectraBase Compound ID | 4xLVaUbWnlB |
|---|---|
| InChI | InChI=1S/C40H56/c1-31(19-13-21-33(3)25-27-37-35(5)23-15-29-39(37,7)8)17-11-12-18-32(2)20-14-22-34(4)26-28-38-36(6)24-16-30-40(38,9)10/h11-14,17-22,25-28H,15-16,23-24,29-30H2,1-10H3/b12-11+,19-13-,20-14+,27-25+,28-26+,31-17+,32-18+,33-21+,34-22+ |
| InChIKey | OENHQHLEOONYIE-WDYSRMTJSA-N |
| Mol Weight | 536.9 g/mol |
| Molecular Formula | C40H56 |
| Exact Mass | 536.438202 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JuIXNpowDy4 |
|---|---|
| Name | (5'z)-.epsilon.,.psi.-carotin |
| Alternate Name(s) | 1,3,3-trimethyl-2-[(1E,3E,5Z,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethyl-1-cyclohexenyl)octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohexene (5Z)-.psi.,.psi.-carotin 1,3,3-trimethyl-2-[(1E,3E,5Z,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethylcyclohexen-1-yl)octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohexene (5Z)-lycopene (5Z)-lycopin .beta.,.psi.-Carotene, 5'-cis- |
| CAS Registry Number | 101468-85-3 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C40H56 |
| InChI | InChI=1S/C40H56/c1-31(19-13-21-33(3)25-27-37-35(5)23-15-29-39(37,7)8)17-11-12-18-32(2)20-14-22-34(4)26-28-38-36(6)24-16-30-40(38,9)10/h11-14,17-22,25-28H,15-16,23-24,29-30H2,1-10H3/b12-11+,19-13-,20-14+,27-25+,28-26+,31-17+,32-18+,33-21+,34-22+ |
| InChIKey | OENHQHLEOONYIE-WDYSRMTJSA-N |
| Molecular Weight | 536.888 g/mol |
| SMILES | C1(\C=C\C(=C\C=C/C(=C/C=C/C=C/(\C=C\C=C\(\C=C\C2=C(CCCC2(C)C)C)C)C)C)C)=C(CCCC1(C)C)C |
| SPLASH | splash10-014i-9000130000-2cbeb91f1f03124dbd55 |
| Source of Spectrum | H-68-1538-14 |
| Wiley ID | 1404172 |