For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

1-Naphthoic acid, 2,2,2-trichloroethyl ester

View entire compound with spectra: 1 NMR, and 1 FTIR

1-Naphthoic acid, 2,2,2-trichloroethyl ester
SpectraBase Compound ID CIdNUCP6nI8
InChI InChI=1S/C13H9Cl3O2/c14-13(15,16)8-18-12(17)11-7-3-5-9-4-1-2-6-10(9)11/h1-7H,8H2
InChIKey SQDBIAIEUYOBDO-UHFFFAOYSA-N
Mol Weight 303.57 g/mol
Molecular Formula C13H9Cl3O2
Exact Mass 301.966813 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 8A94ibGtrKs
Name 1-Naphthoic acid, 2,2,2-trichloroethyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 301.966812628 u
Formula C13H9Cl3O2
InChI InChI=1S/C13H9Cl3O2/c14-13(15,16)8-18-12(17)11-7-3-5-9-4-1-2-6-10(9)11/h1-7H,8H2
InChIKey SQDBIAIEUYOBDO-UHFFFAOYSA-N
Molecular Weight 303.572 g/mol
SMILES C12=CC=CC=C2C(=CC=C1)C(=O)OCC(Cl)(Cl)Cl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.904401