| SpectraBase Spectrum ID |
EEfjZ96d2Cs |
| Name |
Benzoic acid, 4-fluoro-3-nitro-, 2,4-bis(1,1-dimethylpropyl)phenyl ester |
| Alternate Name(s) |
4-(4-Methoxyphenyl)-2,3,5-triphenyl-3H-pyrrole
2,4-Bis(2-methylbutan-2-yl)phenyl 4-fluoro-3-nitrobenzoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H23NO |
| InChI |
InChI=1S/C29H23NO/c1-31-25-19-17-22(18-20-25)27-26(21-11-5-2-6-12-21)28(23-13-7-3-8-14-23)30-29(27)24-15-9-4-10-16-24/h2-20,26H,1H3 |
| InChIKey |
OKWRAWNDGKACEG-UHFFFAOYSA-N |
| Molecular Weight |
401.509 g/mol |
| SMILES |
COc1ccc(cc1)C1=C(N=C(c2ccccc2)C1c1ccccc1)c1ccccc1 |
| SPLASH |
splash10-0udi-0221900000-9347a3e41d39e2e474d8 |
| Source of Spectrum |
JX-2015-4-13 |
| Wiley ID |
1725471 |
