| SpectraBase Compound ID | 1AAwjGTZ28c |
|---|---|
| InChI | InChI=1S/C15H19NO6/c1-11(2)10-21-14(17)8-5-9-15(18)22-13-7-4-3-6-12(13)16(19)20/h3-4,6-7,11H,5,8-10H2,1-2H3 |
| InChIKey | ASIGKQGJCJUZHU-UHFFFAOYSA-N |
| Mol Weight | 309.32 g/mol |
| Molecular Formula | C15H19NO6 |
| Exact Mass | 309.121237 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Hvc8nqVDSui |
|---|---|
| Name | Glutaric acid, isobutyl 2-nitrophenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 309.121237330 u |
| Formula | C15H19NO6 |
| InChI | InChI=1S/C15H19NO6/c1-11(2)10-21-14(17)8-5-9-15(18)22-13-7-4-3-6-12(13)16(19)20/h3-4,6-7,11H,5,8-10H2,1-2H3 |
| InChIKey | ASIGKQGJCJUZHU-UHFFFAOYSA-N |
| Molecular Weight | 309.318 g/mol |
| SMILES | CC(C)COC(CCCC(OC1=CC=CC=C1N(=O)=O)=O)=O |