| SpectraBase Spectrum ID |
KDtV8IXaUHT |
| Name |
(4E,8E,12E,16E)-4,8,13,17,21-Pentamethyl-4,8,12,16,20-docosapentaenal |
| Comments |
Note: The molecular formula of the structure shown is C27H44O - which differs from the formula reported for the mass spectrum (C27H41D3O) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H41D3O |
| InChI |
InChI=1S/C27H44O/c1-23(2)13-9-16-26(5)19-10-17-24(3)14-7-8-15-25(4)18-11-20-27(6)21-12-22-28/h13-15,19-20,22H,7-12,16-18,21H2,1-6H3/b24-14+,25-15+,26-19+,27-20+ |
| InChIKey |
MNYUIBWKSTZJLY-OGDZRKEVSA-N |
| Molecular Weight |
384.648 g/mol |
| SMILES |
CC(C)=CCC\C(C)=C\CC\C(=C\CC\C=C/(C)CC\C=C/(C)CCC=O)C |
| SPLASH |
splash10-00m4-9500000000-13fd5c850759b4c392f4 |
| Synonyms |
(4E,8E,12E,16E)-4,8,13,17,21-pentamethyldocosa-4,8,12,16,20-pentaenal
Docosa-2,6,10,14,18-pentaen-22-al, 2,6,10,15,18-pentamethyl-, all-trans |
| Wiley ID |
1481220 |
