| SpectraBase Compound ID | GlyzSX8iX2A |
|---|---|
| InChI | InChI=1S/C11H12ClNO4/c1-7(13(16)17)10(6-11(14)15)8-2-4-9(12)5-3-8/h2-5,7,10H,6H2,1H3,(H,14,15) |
| InChIKey | HDZPYFZKPILPHY-UHFFFAOYSA-N |
| Mol Weight | 257.67 g/mol |
| Molecular Formula | C11H12ClNO4 |
| Exact Mass | 257.045486 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CvbRZ13xj2H |
|---|---|
| Name | 3-(4-Chlorophenyl)-4-nitropentanoic acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H12ClNO4 |
| InChI | InChI=1S/C11H12ClNO4/c1-7(13(16)17)10(6-11(14)15)8-2-4-9(12)5-3-8/h2-5,7,10H,6H2,1H3,(H,14,15) |
| InChIKey | HDZPYFZKPILPHY-UHFFFAOYSA-N |
| Molecular Weight | 257.673 g/mol |
| SMILES | OC(CC(C(N(=O)=O)C)c1ccc(cc1)Cl)=O |
| SPLASH | splash10-052r-0950000000-8d9ae78d69ce95d42e7e |
| Source of Spectrum | B-47-1441-0 |
| Wiley ID | 1260554 |