| SpectraBase Compound ID | 42SxbotJ3Tg |
|---|---|
| InChI | InChI=1S/C8H20O6P2/c9-15(10,11)7-5-3-1-2-4-6-8-16(12,13)14/h1-8H2,(H2,9,10,11)(H2,12,13,14) |
| InChIKey | VRAVNKVHQXXAQW-UHFFFAOYSA-N |
| Mol Weight | 274.19 g/mol |
| Molecular Formula | C8H20O6P2 |
| Exact Mass | 274.073512 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 979YybnAteK |
|---|---|
| Name | C8 bis Phosphonic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 274.073512354 u |
| Formula | C8H20O6P2 |
| InChI | InChI=1S/C8H20O6P2/c9-15(10,11)7-5-3-1-2-4-6-8-16(12,13)14/h1-8H2,(H2,9,10,11)(H2,12,13,14) |
| InChIKey | VRAVNKVHQXXAQW-UHFFFAOYSA-N |
| Molecular Weight | 274.190 g/mol |
| SMILES | OP(CCCCCCCCP(=O)(O)O)(=O)O |