| SpectraBase Spectrum ID |
HlghPjceMfZ |
| Name |
2-(4-Nitro-benzoyl)-but-2-enedioic acid diethyl ester |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H15NO7 |
| InChI |
InChI=1S/C15H15NO7/c1-3-22-13(17)9-12(15(19)23-4-2)14(18)10-5-7-11(8-6-10)16(20)21/h5-9H,3-4H2,1-2H3/b12-9+ |
| InChIKey |
HPYDERGRZRNSQR-FMIVXFBMSA-N |
| Molecular Weight |
321.285 g/mol |
| SMILES |
C(\C(=C/C(=O)OCC)C(=O)OCC)(c1ccc(N(=O)=O)cc1)=O |
| SPLASH |
splash10-00di-0009000000-4845c8220d0cda50d6e2 |
| Source of Spectrum |
F-67-5787-1d |
| Synonyms |
(E)-2-[(4-nitrophenyl)-oxomethyl]-2-butenedioic acid diethyl ester
diethyl (E)-2-(4-nitrobenzoyl)but-2-enedioate
diethyl (E)-2-(4-nitrophenyl)carbonylbut-2-enedioate |
| Wiley ID |
1687251 |
