| SpectraBase Spectrum ID |
AiluIhaqHb2 |
| Name |
Glutaric acid, 2,2-dichloroethyl 4-fluoro-2-methoxyphenyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
352.028057141 u |
| Formula |
C14H15Cl2FO5 |
| InChI |
InChI=1S/C14H15Cl2FO5/c1-20-11-7-9(17)5-6-10(11)22-14(19)4-2-3-13(18)21-8-12(15)16/h5-7,12H,2-4,8H2,1H3 |
| InChIKey |
IYSWFQPTSOFWRR-UHFFFAOYSA-N |
| Molecular Weight |
353.173 g/mol |
| SMILES |
C(CCC(OCC(Cl)Cl)=O)C(OC1=C(OC)C=C(C=C1)F)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.960621 |
