| SpectraBase Compound ID | 8VLWuLvjSs4 |
|---|---|
| InChI | InChI=1S/C16H27O4P/c1-4-6-12-19-21(18,20-13-7-5-2)16(17)15-10-8-14(3)9-11-15/h8-11,16-17H,4-7,12-13H2,1-3H3/t16-/m1/s1 |
| InChIKey | PVJDHTLHMHPHGN-MRXNPFEDSA-N |
| Mol Weight | 314.36 g/mol |
| Molecular Formula | C16H27O4P |
| Exact Mass | 314.164696 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ag7GFr8xIoA |
|---|---|
| Name | (R)-Dibutyl hydroxy(4-tolyl)methylphosphonate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 314.164696343 u |
| Formula | C16H27O4P |
| InChI | InChI=1S/C16H27O4P/c1-4-6-12-19-21(18,20-13-7-5-2)16(17)15-10-8-14(3)9-11-15/h8-11,16-17H,4-7,12-13H2,1-3H3/t16-/m1/s1 |
| InChIKey | PVJDHTLHMHPHGN-MRXNPFEDSA-N |
| Molecular Weight | 314.362 g/mol |
| SMILES | [C@](P(OCCCC)(OCCCC)=O)(C=1C=CC(=CC1)C)(O)[H] |