SpectraBase Spectrum ID |
DPsbTxYM1dG |
Name |
Methyl [2.2](1,3)-adamantanometacyclophane-16-carboxylate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C22H28O2 |
InChI |
InChI=1S/C22H28O2/c1-24-20(23)19-17-10-21-8-6-15-2-3-16(5-4-15)7-9-22(12-17,14-21)13-18(19)11-21/h2-5,17-19H,6-14H2,1H3/t17-,18+,19?,21-,22+ |
InChIKey |
WQRFOKPPDNIUPW-NBMAOANXSA-N |
Molecular Weight |
324.464 g/mol |
SMILES |
[C@]12(C([C@@]3(C[C@]4(C2)C[C@@](C1)(CCc1ccc(CC4)cc1)C3)[H])C(=O)OC)[H] |
SPLASH |
splash10-01ba-0594000000-db35624ca778d0294f76 |
Source of Spectrum |
K-127-2087-5 |
Synonyms |
Methyl pentacyclo[11.2.2.1(4,8).1(4,10).1(6,10)]icosa-1(15),13,16-triene-7-carboxylate |
Wiley ID |
1323702 |