| SpectraBase Compound ID | KZUaHheN6RX |
|---|---|
| InChI | InChI=1S/C13H16N2O5/c1-3-8-20-12(16)9-14(2)13(17)10-4-6-11(7-5-10)15(18)19/h4-7H,3,8-9H2,1-2H3 |
| InChIKey | JDTAJJRQJXNIJX-UHFFFAOYSA-N |
| Mol Weight | 280.28 g/mol |
| Molecular Formula | C13H16N2O5 |
| Exact Mass | 280.105922 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LbUUJqjRVeD |
|---|---|
| Name | Sarcosine, N-(4-nitrobenzoyl-, propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 280.105921618 u |
| Formula | C13H16N2O5 |
| InChI | InChI=1S/C13H16N2O5/c1-3-8-20-12(16)9-14(2)13(17)10-4-6-11(7-5-10)15(18)19/h4-7H,3,8-9H2,1-2H3 |
| InChIKey | JDTAJJRQJXNIJX-UHFFFAOYSA-N |
| Molecular Weight | 280.280 g/mol |
| SMILES | C1=CC(=CC=C1C(N(CC(OCCC)=O)C)=O)N(=O)=O |