| SpectraBase Compound ID | KCCBMRr2dMm |
|---|---|
| InChI | InChI=1S/C15H20N2O5/c1-3-4-5-10-22-14(18)11-16(2)15(19)12-6-8-13(9-7-12)17(20)21/h6-9H,3-5,10-11H2,1-2H3 |
| InChIKey | GQKQRBUEHNOZJK-UHFFFAOYSA-N |
| Mol Weight | 308.33 g/mol |
| Molecular Formula | C15H20N2O5 |
| Exact Mass | 308.137222 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LXsE0AeIlLR |
|---|---|
| Name | Sarcosine, N-(4-nitrobenzoyl)-, pentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 308.137221747 u |
| Formula | C15H20N2O5 |
| InChI | InChI=1S/C15H20N2O5/c1-3-4-5-10-22-14(18)11-16(2)15(19)12-6-8-13(9-7-12)17(20)21/h6-9H,3-5,10-11H2,1-2H3 |
| InChIKey | GQKQRBUEHNOZJK-UHFFFAOYSA-N |
| Molecular Weight | 308.334 g/mol |
| SMILES | C1=CC(=CC=C1C(N(CC(OCCCCC)=O)C)=O)N(=O)=O |