| SpectraBase Spectrum ID |
Eit5CGQ9EtT |
| Name |
Succinic acid, ethyl 2-tert-butylphenyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
278.151809184 u |
| Formula |
C16H22O4 |
| InChI |
InChI=1S/C16H22O4/c1-5-19-14(17)10-11-15(18)20-13-9-7-6-8-12(13)16(2,3)4/h6-9H,5,10-11H2,1-4H3 |
| InChIKey |
JWFQVJSAXVKLHT-UHFFFAOYSA-N |
| Molecular Weight |
278.348 g/mol |
| SMILES |
CC(C)(C1=CC=CC=C1OC(CCC(OCC)=O)=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.809871 |
