| SpectraBase Compound ID | JHdtrYq1VtM |
|---|---|
| InChI | InChI=1S/C40H54O/c1-30(18-13-20-32(3)23-25-37-34(5)22-15-27-39(37,7)8)16-11-12-17-31(2)19-14-21-33(4)24-26-38-35(6)28-36(41)29-40(38,9)10/h11-14,16-21,23,25,36,41H,15,22,27-29H2,1-10H3/b12-11+,18-13+,19-14+,25-23+,30-16+,31-17+,32-20+,33-21-/t36-/m1/s1 |
| InChIKey | UNJKJDIRJWIHLL-MIJIRGNRSA-N |
| Mol Weight | 550.9 g/mol |
| Molecular Formula | C40H54O |
| Exact Mass | 550.417466 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DPefub6mx8G |
|---|---|
| Name | 9Z-(3R)-7,8-Didehydrocryptoxanthin |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C40H54O |
| InChI | InChI=1S/C40H54O/c1-30(18-13-20-32(3)23-25-37-34(5)22-15-27-39(37,7)8)16-11-12-17-31(2)19-14-21-33(4)24-26-38-35(6)28-36(41)29-40(38,9)10/h11-14,16-21,23,25,36,41H,15,22,27-29H2,1-10H3/b12-11+,18-13+,19-14+,25-23+,30-16+,31-17+,32-20+,33-21-/t36-/m1/s1 |
| InChIKey | UNJKJDIRJWIHLL-MIJIRGNRSA-N |
| Molecular Weight | 550.871 g/mol |
| SMILES | O[C@]1(CC(C(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(C1)C)(C)C)[H] |
| SPLASH | splash10-0udi-0000090000-44bbeac3990b02ef4f6b |
| Source of Spectrum | QC-5-1791-2 |
| Wiley ID | 883729 |