SpectraBase Spectrum ID |
1a10ID0iJQ1 |
Name |
Glutaric acid, 2-chloro-6-fluorophenyl 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 |
384.057607604 u |
Formula |
C18H15ClF2O5 |
InChI |
InChI=1S/C18H15ClF2O5/c1-24-15-10-11(20)8-9-14(15)25-16(22)6-3-7-17(23)26-18-12(19)4-2-5-13(18)21/h2,4-5,8-10H,3,6-7H2,1H3 |
InChIKey |
RFOHHLKIRBPFCX-UHFFFAOYSA-N |
Molecular Weight |
384.763 g/mol |
SMILES |
C(CCC(OC1=C(C=CC=C1F)Cl)=O)C(OC1=C(OC)C=C(C=C1)F)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.900305 |