| SpectraBase Compound ID | JFeEbWbpQv8 |
|---|---|
| InChI | InChI=1S/C5H12ClO3P/c1-3-8-10(7,5-6)9-4-2/h3-5H2,1-2H3 |
| InChIKey | MZBIWKMCTWJLPT-UHFFFAOYSA-N |
| Mol Weight | 186.57 g/mol |
| Molecular Formula | C5H12ClO3P |
| Exact Mass | 186.021259 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | AmQHSFdoXSa |
|---|---|
| Name | Chloromethyl-phosphonic-acid-diethylester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 186.021258941 u |
| Formula | C5H12ClO3P |
| InChI | InChI=1S/C5H12ClO3P/c1-3-8-10(7,5-6)9-4-2/h3-5H2,1-2H3 |
| InChIKey | MZBIWKMCTWJLPT-UHFFFAOYSA-N |
| Molecular Weight | 186.575 g/mol |
| SMILES | C(OP(=O)(OCC)CCl)C |
| Spectrum/Structure Validation Score (Raman) | 0.907576 |