SpectraBase Compound ID | 2wx0vp9pGYp |
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InChI | InChI=1S/C10H21O5P/c1-3-14-16(11,15-4-2)7-5-6-12-8-10-9-13-10/h10H,3-9H2,1-2H3 |
InChIKey | PCAJGNDUGRGSNK-UHFFFAOYSA-N |
Mol Weight | 252.25 g/mol |
Molecular Formula | C10H21O5P |
Exact Mass | 252.112661 g/mol |
SpectraBase Spectrum ID | 5XfKsTa1JMT |
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Name | Epoxy C3 diethylphosphonate |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 252.112660769 u |
Formula | C10H21O5P |
InChI | InChI=1S/C10H21O5P/c1-3-14-16(11,15-4-2)7-5-6-12-8-10-9-13-10/h10H,3-9H2,1-2H3 |
InChIKey | PCAJGNDUGRGSNK-UHFFFAOYSA-N |
Molecular Weight | 252.247 g/mol |
SMILES | C(OCC1CO1)CCP(=O)(OCC)OCC |
Spectrum/Structure Validation Score (Raman) | 0.966694 |