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

*Links on SpectraBase are not permalinks.

Pimelic acid, ethyl 2-naphthyl ester

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

Pimelic acid, ethyl 2-naphthyl ester
SpectraBase Compound ID 1nAfGOzsJgZ
InChI InChI=1S/C19H22O4/c1-2-22-18(20)10-4-3-5-11-19(21)23-17-13-12-15-8-6-7-9-16(15)14-17/h6-9,12-14H,2-5,10-11H2,1H3
InChIKey LTLZWADKIZGYPX-UHFFFAOYSA-N
Mol Weight 314.38 g/mol
Molecular Formula C19H22O4
Exact Mass 314.151809 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 CcCkHKmQ69E
Name Pimelic acid, ethyl 2-naphthyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 314.151809184 u
Formula C19H22O4
InChI InChI=1S/C19H22O4/c1-2-22-18(20)10-4-3-5-11-19(21)23-17-13-12-15-8-6-7-9-16(15)14-17/h6-9,12-14H,2-5,10-11H2,1H3
InChIKey LTLZWADKIZGYPX-UHFFFAOYSA-N
Molecular Weight 314.381 g/mol
SMILES C(OC1=CC=C2C(=C1)C=CC=C2)(=O)CCCCCC(OCC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.902014