| SpectraBase Spectrum ID |
40k0NJGuZhS |
| Name |
Succinic acid, 3-methylbut-2-en-1-yl 2-ethylphenyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
290.151809184 u |
| Formula |
C17H22O4 |
| InChI |
InChI=1S/C17H22O4/c1-4-14-7-5-6-8-15(14)21-17(19)10-9-16(18)20-12-11-13(2)3/h5-8,11H,4,9-10,12H2,1-3H3 |
| InChIKey |
CFPKSPGUVVOBPU-UHFFFAOYSA-N |
| SMILES |
C(CC(OCC=C(C)C)=O)C(OC=1C(CC)=CC=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.956795 |
