| SpectraBase Compound ID | K2eLH4QBWwE |
|---|---|
| InChI | InChI=1S/C40H60O2/c1-29(17-13-19-31(3)21-23-35-33(5)37(41)25-27-39(35,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-36-34(6)38(42)26-28-40(36,9)10/h11-24,33-38,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,29-15+,30-16+,31-19+,32-20+ |
| InChIKey | JNTVTBGQHNNOKM-DKLMTRRASA-N |
| Mol Weight | 572.9 g/mol |
| Molecular Formula | C40H60O2 |
| Exact Mass | 572.459331 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7a30XsL2VuG |
|---|---|
| Name | 5,6,5',6'-Tetrahydro-.beta.,.beta.-carotene-4,4'-diol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C40H60O2 |
| InChI | InChI=1S/C40H60O2/c1-29(17-13-19-31(3)21-23-35-33(5)37(41)25-27-39(35,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-36-34(6)38(42)26-28-40(36,9)10/h11-24,33-38,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,29-15+,30-16+,31-19+,32-20+ |
| InChIKey | JNTVTBGQHNNOKM-DKLMTRRASA-N |
| Molecular Weight | 572.918 g/mol |
| SMILES | OC1C(C(\C=C\C(=C\C=C\C(=C\C=C\C=C\(\C=C\C=C\(\C=C\C2C(C(CCC2(C)C)O)C)C)C)C)C)C(CC1)(C)C)C |
| SPLASH | splash10-00di-0000290000-d9213d1f9f0243a048f7 |
| Source of Spectrum | G4-64-1141-1 |
| Synonyms | 5,5',6,6'-tetrahydro-beta,.beta.-carotene-4,4'-diol 3-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-(5-hydroxy-2,2,6-trimethylcyclohexyl)-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaenyl]-2,4,4-trimethyl-1-cyclohexanol 3-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-(5-hydroxy-2,2,6-trimethylcyclohexyl)-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaenyl]-2,4,4-trimethylcyclohexan-1-ol 2,4,4-trimethyl-3-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-(2,2,6-trimethyl-5-oxidanyl-cyclohexyl)octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohexan-1-ol |
| Wiley ID | 1609176 |