| SpectraBase Compound ID | HE6xso0jatQ |
|---|---|
| InChI | InChI=1S/C10H10N2O5/c13-9(14)5-6-11-10(15)7-1-3-8(4-2-7)12(16)17/h1-4H,5-6H2,(H,11,15)(H,13,14) |
| InChIKey | PDTLZWITKYGYDN-UHFFFAOYSA-N |
| Mol Weight | 238.2 g/mol |
| Molecular Formula | C10H10N2O5 |
| Exact Mass | 238.058971 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | EyDwW8X5qld |
|---|---|
| Name | N-(4-nitrobenzoyl)-beta-alanine |
| Source of Sample | Sigma-Aldrich Co. LLC. |
| Catalog Number | 233447 |
| CAS Registry Number | 59642-21-6 |
| Copyright | Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C10H10N2O5 |
| InChI | 1S/C10H10N2O5/c13-9(14)5-6-11-10(15)7-1-3-8(4-2-7)12(16)17/h1-4H,5-6H2,(H,11,15)(H,13,14) |
| InChIKey | PDTLZWITKYGYDN-UHFFFAOYSA-N |
| Observed nucleus | 1H |
| Purity | 98% |
| Solvent | DMSO-d6 |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Wiley ID | SIAL_1HNMR_003606 |