| SpectraBase Spectrum ID |
Iae0gnm81sY |
| Name |
Phthalic acid, 2-adamantyl ethyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
328.167459249 u |
| Formula |
C20H24O4 |
| InChI |
InChI=1S/C20H24O4/c1-2-23-19(21)16-5-3-4-6-17(16)20(22)24-18-14-8-12-7-13(10-14)11-15(18)9-12/h3-6,12-15,18H,2,7-11H2,1H3/t12-,13+,14-,15+,18- |
| InChIKey |
GBNWLKCUXRENOR-NYDXYTTESA-N |
| Molecular Weight |
328.408 g/mol |
| SMILES |
C1(=CC=CC=C1C(OC1[C@]2(C[C@@]3(C[C@@](C[C@]1(C3)[H])(C2)[H])[H])[H])=O)C(=O)OCC |
