| SpectraBase Spectrum ID |
H73Elq7GpRn |
| Name |
1-Adamantanecarboxylic acid, 2-isopropoxyphenyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
314.188194694 u |
| Formula |
C20H26O3 |
| InChI |
InChI=1S/C20H26O3/c1-13(2)22-17-5-3-4-6-18(17)23-19(21)20-10-14-7-15(11-20)9-16(8-14)12-20/h3-6,13-16H,7-12H2,1-2H3/t14-,15+,16-,20- |
| InChIKey |
IDJJELDSZUIQGL-BMWJPVITSA-N |
| SMILES |
C1(OC(=O)C23C[C@]4(C[C@@](C3)(C[C@](C4)(C2)[H])[H])[H])=C(C=CC=C1)OC(C)C |
