| SpectraBase Compound ID | BsF9pI3cAp9 |
|---|---|
| InChI | InChI=1S/C8H12NO4P/c1-11-14(10,12-2)13-8-5-3-7(9)4-6-8/h3-6H,9H2,1-2H3 |
| InChIKey | IDKBQJHRJVRQHG-UHFFFAOYSA-N |
| Mol Weight | 217.16 g/mol |
| Molecular Formula | C8H12NO4P |
| Exact Mass | 217.050395 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 6yGfSGCq4nP |
|---|---|
| Name | Phosphoric acid, (4-aminophenyl) dimethyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 217.050394864 u |
| Formula | C8H12NO4P |
| InChI | InChI=1S/C8H12NO4P/c1-11-14(10,12-2)13-8-5-3-7(9)4-6-8/h3-6H,9H2,1-2H3 |
| InChIKey | IDKBQJHRJVRQHG-UHFFFAOYSA-N |
| Molecular Weight | 217.161 g/mol |
| SMILES | COP(OC)(=O)OC1=CC=C(C=C1)N |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.831672 |