| SpectraBase Compound ID | GInyefBMtjb |
|---|---|
| InChI | InChI=1S/C20H29NO6/c1-2-3-4-5-6-7-10-15-26-19(22)13-14-20(23)27-16-17-11-8-9-12-18(17)21(24)25/h8-9,11-12H,2-7,10,13-16H2,1H3 |
| InChIKey | USAGVWIJWWDXQF-UHFFFAOYSA-N |
| Mol Weight | 379.45 g/mol |
| Molecular Formula | C20H29NO6 |
| Exact Mass | 379.199488 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | G8ReXBJDoRy |
|---|---|
| Name | Succinic acid, 2-nitrobenzyl nonyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 379.199487652 u |
| Formula | C20H29NO6 |
| InChI | InChI=1S/C20H29NO6/c1-2-3-4-5-6-7-10-15-26-19(22)13-14-20(23)27-16-17-11-8-9-12-18(17)21(24)25/h8-9,11-12H,2-7,10,13-16H2,1H3 |
| InChIKey | USAGVWIJWWDXQF-UHFFFAOYSA-N |
| Molecular Weight | 379.453 g/mol |
| SMILES | C1=CC=C(C(=C1)N(=O)=O)COC(=O)CCC(OCCCCCCCCC)=O |