| SpectraBase Spectrum ID |
LH2VH6fPtq |
| Name |
Succinic acid, cyclohexylmethyl (2-methylcyclohex-1-en-1-yl)methyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
322.214409442 u |
| Formula |
C19H30O4 |
| InChI |
InChI=1S/C19H30O4/c1-15-7-5-6-10-17(15)14-23-19(21)12-11-18(20)22-13-16-8-3-2-4-9-16/h16H,2-14H2,1H3 |
| InChIKey |
NJJFXGNPGTUADD-UHFFFAOYSA-N |
| Molecular Weight |
322.445 g/mol |
| SMILES |
C(CC(OCC1CCCCC1)=O)C(OCC1=C(C)CCCC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.97726 |
