SpectraBase Spectrum ID |
Fhm9v8QCoh1 |
Name |
1-Adamantanecarboxylic acid, 1-cyclopentylethyl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
276.208930140 u |
Formula |
C18H28O2 |
InChI |
InChI=1S/C18H28O2/c1-12(16-4-2-3-5-16)20-17(19)18-9-13-6-14(10-18)8-15(7-13)11-18/h12-16H,2-11H2,1H3/t12?,13-,14+,15-,18- |
InChIKey |
BURRFGDWEAFZRW-ZNDYJMPUSA-N |
Molecular Weight |
276.420 g/mol |
SMILES |
C1CCCC1C(OC(C12C[C@]3(C[C@@](C2)(C[C@](C3)(C1)[H])[H])[H])=O)C |