| SpectraBase Compound ID | FNCpTdFQFw3 |
|---|---|
| InChI | InChI=1S/C40H54O/c1-31(18-12-19-33(3)24-26-37-34(4)21-14-28-39(37,6)7)16-10-11-17-32(2)20-13-23-36(30-41)25-27-38-35(5)22-15-29-40(38,8)9/h10-13,16-20,23-27,30H,14-15,21-22,28-29H2,1-9H3/b11-10+,18-12+,20-13+,26-24+,27-25+,31-16+,32-17+,33-19+,36-23- |
| InChIKey | IIAPKASFQRPUTN-BRGFQONPSA-N |
| Mol Weight | 550.9 g/mol |
| Molecular Formula | C40H54O |
| Exact Mass | 550.417466 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 6KF7QK9T0st |
|---|---|
| Name | .beta.,.beta.-Caroten-19-al |
| CAS Registry Number | 87162-21-8 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C40H54O |
| InChI | InChI=1S/C40H54O/c1-31(18-12-19-33(3)24-26-37-34(4)21-14-28-39(37,6)7)16-10-11-17-32(2)20-13-23-36(30-41)25-27-38-35(5)22-15-29-40(38,8)9/h10-13,16-20,23-27,30H,14-15,21-22,28-29H2,1-9H3/b11-10+,18-12+,20-13+,26-24+,27-25+,31-16+,32-17+,33-19+,36-23- |
| InChIKey | IIAPKASFQRPUTN-BRGFQONPSA-N |
| Molecular Weight | 550.871 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=O)=C(CCCC1(C)C)C |
| SPLASH | splash10-0f6x-9500010000-bf5281635826598e5627 |
| Source of Spectrum | H-66-1166-0 |
| Synonyms | .beta.,.beta.-carotin-19-al beta,.beta.-caroten-19-al |
| Wiley ID | 1405805 |