| SpectraBase Spectrum ID |
5U9TYeWm3P1 |
| Name |
Benzeneheneicosanoic acid, 4-(6-phenyl-1,3,5-hexatrienyl)-, methyl ester, (E,E,E)- |
| Alternate Name(s) |
Methyl 21 -dph-henicosanoate
Methyl 21-{4-[(1E,3E,5E)-6-phenyl-1,3,5-hexatrienyl]phenyl}henicosanoate |
| CAS Registry Number |
128368-81-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C40H58O2 |
| InChI |
InChI=1S/C40H58O2/c1-42-40(41)32-26-17-15-13-11-9-7-5-3-2-4-6-8-10-12-14-16-21-30-38-33-35-39(36-34-38)31-23-19-18-22-27-37-28-24-20-25-29-37/h18-20,22-25,27-29,31,33-36H,2-17,21,26,30,32H2,1H3/b19-18+,27-22+,31-23+ |
| InChIKey |
BPWNRUFHTWLUEK-NIRLUNTMSA-N |
| Molecular Weight |
570.902 g/mol |
| SMILES |
C(=O)(OC)CCCCCCCCCCCCCCCCCCCCc1ccc(\C=C\C=C\C=C\c2ccccc2)cc1 |
| SPLASH |
splash10-0ac0-9130030000-44034e3d4b235450b56f |
| Source of Spectrum |
F-47-1469-28 |
| Wiley ID |
1407773 |
