| SpectraBase Spectrum ID |
5NQD3ne8trt |
| Name |
Succinic acid, hexyl 2-phenylethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
306.183109313 u |
| Formula |
C18H26O4 |
| InChI |
InChI=1S/C18H26O4/c1-2-3-4-8-14-21-17(19)11-12-18(20)22-15-13-16-9-6-5-7-10-16/h5-7,9-10H,2-4,8,11-15H2,1H3 |
| InChIKey |
YGQFMGSMIVMDQS-UHFFFAOYSA-N |
| Molecular Weight |
306.402 g/mol |
| SMILES |
C(CCC(OCCC1=CC=CC=C1)=O)(OCCCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.870596 |
