| SpectraBase Spectrum ID |
CS17XCLzr2r |
| Name |
Benzenepropanal, .alpha.-(4-methylphenyl)-4-nitro-.beta.-oxo- |
| CAS Registry Number |
93633-31-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H13NO4 |
| InChI |
InChI=1S/C16H13NO4/c1-11-2-4-12(5-3-11)15(10-18)16(19)13-6-8-14(9-7-13)17(20)21/h2-10,15H,1H3 |
| InChIKey |
ZXCNCRDCTRWXDU-UHFFFAOYSA-N |
| Molecular Weight |
283.283 g/mol |
| SMILES |
c1(N(=O)=O)ccc(C(C(c2ccc(cc2)C)C=O)=O)cc1 |
| SPLASH |
splash10-001i-0490000000-fd1b33b7d8c64a9e6ccd |
| Source of Spectrum |
O-19-483-6 |
| Synonyms |
2-(4-Methylphenyl)-3-(4-nitrophenyl)-3-oxopropanal
3-(4-Nitrophenyl)-3-oxo-2-(4-methylphenyl)-1-propanal |
| Wiley ID |
1286963 |
