| SpectraBase Compound ID | J4EtUreNNvV |
|---|---|
| InChI | InChI=1S/C13H20NO6P/c1-4-18-21(16,19-5-2)12(20-13(14)15)10-6-8-11(17-3)9-7-10/h6-9,12H,4-5H2,1-3H3,(H2,14,15) |
| InChIKey | FNQIQCNVJIQZFF-UHFFFAOYSA-N |
| Mol Weight | 317.28 g/mol |
| Molecular Formula | C13H20NO6P |
| Exact Mass | 317.102824 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2ETnGStUV7S |
|---|---|
| Name | alpha-Diethoxyphosphono-alpha-para-methoxyphenylmethylcarbamate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 317.102824360 u |
| Formula | C13H20NO6P |
| InChI | InChI=1S/C13H20NO6P/c1-4-18-21(16,19-5-2)12(20-13(14)15)10-6-8-11(17-3)9-7-10/h6-9,12H,4-5H2,1-3H3,(H2,14,15) |
| InChIKey | FNQIQCNVJIQZFF-UHFFFAOYSA-N |
| Molecular Weight | 317.278 g/mol |
| SMILES | NC(=O)OC(P(OCC)(=O)OCC)c1ccc(cc1)OC |