| SpectraBase Spectrum ID |
Vsur5fpnBu |
| Name |
Butylphosphonic acid, 1-adamantylmethyl pentyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
356.248032046 u |
| Formula |
C20H37O3P |
| InChI |
InChI=1S/C20H37O3P/c1-3-5-7-8-22-24(21,9-6-4-2)23-16-20-13-17-10-18(14-20)12-19(11-17)15-20/h17-19H,3-16H2,1-2H3/t17-,18+,19-,20-,24? |
| InChIKey |
CVBGIMSBQDJZJI-RZMKQXJRSA-N |
| Molecular Weight |
356.487 g/mol |
| SMILES |
C(OP(CCCC)(OCCCCC)=O)C12C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H] |
