SpectraBase Spectrum ID |
7sE73lY3I3Y |
Name |
Succinic acid, 2-chloro-6-fluorophenyl 2,3-dimethylphenyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
350.072114854 u |
Formula |
C18H16ClFO4 |
InChI |
InChI=1S/C18H16ClFO4/c1-11-5-3-8-15(12(11)2)23-16(21)9-10-17(22)24-18-13(19)6-4-7-14(18)20/h3-8H,9-10H2,1-2H3 |
InChIKey |
SXOVXROUFOQYIO-UHFFFAOYSA-N |
Molecular Weight |
350.773 g/mol |
SMILES |
C(CC(OC1=C(C=CC=C1F)Cl)=O)C(OC1=C(C(C)=CC=C1)C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.826801 |