SpectraBase Compound ID | F6XrxyEetMb |
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InChI | InChI=1S/C14H31O4P/c1-4-7-9-11-13-17-19(15,16-6-3)18-14-12-10-8-5-2/h4-14H2,1-3H3 |
InChIKey | PJUWDWLIKQZRKX-UHFFFAOYSA-N |
Mol Weight | 294.37 g/mol |
Molecular Formula | C14H31O4P |
Exact Mass | 294.195996 g/mol |
SpectraBase Spectrum ID | 7Jxeamxk1GW |
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Name | Phosphoric acid, dihexyl ethyl ester |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 294.195996472 u |
Formula | C14H31O4P |
InChI | InChI=1S/C14H31O4P/c1-4-7-9-11-13-17-19(15,16-6-3)18-14-12-10-8-5-2/h4-14H2,1-3H3 |
InChIKey | PJUWDWLIKQZRKX-UHFFFAOYSA-N |
Molecular Weight | 294.372 g/mol |
SMILES | CCCCCCOP(OCC)(OCCCCCC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.885592 |