| SpectraBase Compound ID | AVGLUSq5XHX |
|---|---|
| InChI | InChI=1S/C14H17NO6/c1-2-10-20-13(16)8-5-9-14(17)21-12-7-4-3-6-11(12)15(18)19/h3-4,6-7H,2,5,8-10H2,1H3 |
| InChIKey | RWWJXUNBLTUGSI-UHFFFAOYSA-N |
| Mol Weight | 295.29 g/mol |
| Molecular Formula | C14H17NO6 |
| Exact Mass | 295.105587 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1vXmnvvmcBs |
|---|---|
| Name | Glutaric acid, 2-nitrophenyl propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 295.105587265 u |
| Formula | C14H17NO6 |
| InChI | InChI=1S/C14H17NO6/c1-2-10-20-13(16)8-5-9-14(17)21-12-7-4-3-6-11(12)15(18)19/h3-4,6-7H,2,5,8-10H2,1H3 |
| InChIKey | RWWJXUNBLTUGSI-UHFFFAOYSA-N |
| Molecular Weight | 295.291 g/mol |
| SMILES | CCCOC(CCCC(OC1=CC=CC=C1N(=O)=O)=O)=O |