SpectraBase Compound ID | 7SqVybLPN8C |
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InChI | InChI=1S/C3H9O4P/c1-6-8(5,3-4)7-2/h4H,3H2,1-2H3 |
InChIKey | OIERWUPLBOKSRB-UHFFFAOYSA-N |
Mol Weight | 140.07 g/mol |
Molecular Formula | C3H9O4P |
Exact Mass | 140.023846 g/mol |
SpectraBase Spectrum ID | IA1ZYQOvoZQ |
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Name | Dimethyl hydroxymethylphosphonate |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 140.023845764 u |
Formula | C3H9O4P |
InChI | InChI=1S/C3H9O4P/c1-6-8(5,3-4)7-2/h4H,3H2,1-2H3 |
InChIKey | OIERWUPLBOKSRB-UHFFFAOYSA-N |
Molecular Weight | 140.075 g/mol |
SMILES | OCP(=O)(OC)OC |
Spectrum/Structure Validation Score (Raman) | 0.800851 |