SpectraBase Spectrum ID |
I0tiaT0WLCk |
Name |
Succinic acid, 2-(adamant-1-yl)ethyl dec-2-yl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
420.323959893 u |
Formula |
C26H44O4 |
InChI |
InChI=1S/C26H44O4/c1-3-4-5-6-7-8-9-20(2)30-25(28)11-10-24(27)29-13-12-26-17-21-14-22(18-26)16-23(15-21)19-26/h20-23H,3-19H2,1-2H3/t20?,21-,22+,23-,26+ |
InChIKey |
INTQLLOQZJGSNQ-IHOJPZBYSA-N |
Molecular Weight |
420.634 g/mol |
SMILES |
C(CC(OC(CCCCCCCC)C)=O)C(OCCC12C[C@]3(C[C@](C[C@](C3)(C1)[H])(C2)[H])[H])=O |