| SpectraBase Compound ID | GX6oWIrRUbT |
|---|---|
| InChI | InChI=1S/C7H13O6P/c1-6(5-7(8)10-2)13-14(9,11-3)12-4/h5H,1-4H3 |
| InChIKey | GEPDYQSQVLXLEU-UHFFFAOYSA-N |
| Mol Weight | 224.15 g/mol |
| Molecular Formula | C7H13O6P |
| Exact Mass | 224.044975 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 3fSCAYuxWbc |
|---|---|
| Name | Phosdrin |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 224.044975131 u |
| Formula | C7H13O6P |
| InChI | InChI=1S/C7H13O6P/c1-6(5-7(8)10-2)13-14(9,11-3)12-4/h5H,1-4H3 |
| InChIKey | GEPDYQSQVLXLEU-UHFFFAOYSA-N |
| Molecular Weight | 224.149 g/mol |
| SMILES | C(C(OC)=O)=C(OP(OC)(=O)OC)C |
| Spectrum/Structure Validation Score (Raman) | 0.893984 |