| SpectraBase Spectrum ID |
CEhayIZz8gs |
| Name |
Butylphosphonic acid, 1-adamantylmethyl ethyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
314.201081853 u |
| Formula |
C17H31O3P |
| InChI |
InChI=1S/C17H31O3P/c1-3-5-6-21(18,19-4-2)20-13-17-10-14-7-15(11-17)9-16(8-14)12-17/h14-16H,3-13H2,1-2H3/t14-,15+,16-,17-,21? |
| InChIKey |
LRNOKPQWRNYBPP-JERPZMTRSA-N |
| Molecular Weight |
314.406 g/mol |
| SMILES |
C1[C@]2(C[C@]3(C[C@@]1(CC(C2)(C3)COP(CCCC)(OCC)=O)[H])[H])[H] |
