| SpectraBase Compound ID | 5BwZimQ90qN |
|---|---|
| InChI | InChI=1S/C10H10N2O5/c1-17-9(13)6-11-10(14)7-3-2-4-8(5-7)12(15)16/h2-5H,6H2,1H3,(H,11,14) |
| InChIKey | SRHCLZBLAYUMEW-UHFFFAOYSA-N |
| Mol Weight | 238.2 g/mol |
| Molecular Formula | C10H10N2O5 |
| Exact Mass | 238.058971 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | Ld1Hh4xd8Br |
|---|---|
| Name | Methyl N-(3-nitrobenzoyl)glycinate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 238.058971425 u |
| Formula | C10H10N2O5 |
| InChI | InChI=1S/C10H10N2O5/c1-17-9(13)6-11-10(14)7-3-2-4-8(5-7)12(15)16/h2-5H,6H2,1H3,(H,11,14) |
| InChIKey | SRHCLZBLAYUMEW-UHFFFAOYSA-N |
| Molecular Weight | 238.199 g/mol |
| SMILES | C1(N(=O)=O)=CC(C(NCC(=O)OC)=O)=CC=C1 |