| SpectraBase Spectrum ID |
GQQk58Aj0cW |
| Name |
Succinic acid, butyl 2-(2-chlorophenoxy)ethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
328.107751471 u |
| Formula |
C16H21ClO5 |
| InChI |
InChI=1S/C16H21ClO5/c1-2-3-10-21-15(18)8-9-16(19)22-12-11-20-14-7-5-4-6-13(14)17/h4-7H,2-3,8-12H2,1H3 |
| InChIKey |
HRAXHLDFUFFIGK-UHFFFAOYSA-N |
| Molecular Weight |
328.792 g/mol |
| SMILES |
C(CCC(OCCOC1=CC=CC=C1Cl)=O)(OCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.936117 |
