| SpectraBase Spectrum ID |
1kNpGMm1BZt |
| Name |
3,5-Dinitrobenzoic acid, 3,7,11-trimethyldodeca-2,6,10-trienyl ester |
| CAS Registry Number |
54605-44-6 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H28N2O6 |
| InChI |
InChI=1S/C22H28N2O6/c1-16(2)7-5-8-17(3)9-6-10-18(4)11-12-30-22(25)19-13-20(23(26)27)15-21(14-19)24(28)29/h7,9,11,13-15H,5-6,8,10,12H2,1-4H3/b17-9+,18-11+ |
| InChIKey |
USBMHHFLANDNDS-XURGJTJWSA-N |
| Molecular Weight |
416.474 g/mol |
| SMILES |
C(=O)(OC\C=C\(CC\C=C\(CCC=C(C)C)C)C)c1cc(cc(c1)N(=O)=O)N(=O)=O |
| SPLASH |
splash10-014i-9400000000-569c962da92d3c382b02 |
| Synonyms |
(2E,6E)-3,7,11-Trimethyl-2,6,10-dodecatrienyl 3,5-dinitrobenzoate
[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl] 3,5-dinitrobenzoate |
| Wiley ID |
1480401 |
