| SpectraBase Spectrum ID |
CF2JxFqSsIx |
| Name |
Succinic acid, (adamant-1-yl)methyl cyclohexylmethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
362.245709571 u |
| Formula |
C22H34O4 |
| InChI |
InChI=1S/C22H34O4/c23-20(25-14-16-4-2-1-3-5-16)6-7-21(24)26-15-22-11-17-8-18(12-22)10-19(9-17)13-22/h16-19H,1-15H2/t17-,18+,19-,22- |
| InChIKey |
ONUFSWAIMVNJRO-FZKTVRCQSA-N |
| Molecular Weight |
362.510 g/mol |
| SMILES |
C(CC(OCC1CCCCC1)=O)C(OCC12C[C@]3(C[C@](C[C@@](C2)(C3)[H])(C1)[H])[H])=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.948369 |
