| SpectraBase Spectrum ID |
8c7YQA2o0oL |
| Name |
Succinic acid, 2-(adamant-1-yl)ethyl 2-ethylhexyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
392.292659764 u |
| Formula |
C24H40O4 |
| InChI |
InChI=1S/C24H40O4/c1-3-5-6-18(4-2)17-28-23(26)8-7-22(25)27-10-9-24-14-19-11-20(15-24)13-21(12-19)16-24/h18-21H,3-17H2,1-2H3/t18?,19-,20+,21-,24+ |
| InChIKey |
OWSDIYFDCQZMLA-ATJXPJHTSA-N |
| Molecular Weight |
392.580 g/mol |
| SMILES |
C(CC(OCC(CC)CCCC)=O)C(OCCC12C[C@]3(C[C@](C[C@](C3)(C1)[H])(C2)[H])[H])=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.951717 |
