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1-Naphthaleneacetic acid, tetradecyl ester

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

1-Naphthaleneacetic acid, tetradecyl ester
SpectraBase Compound ID F8XJNy4p3QE
InChI InChI=1S/C26H38O2/c1-2-3-4-5-6-7-8-9-10-11-12-15-21-28-26(27)22-24-19-16-18-23-17-13-14-20-25(23)24/h13-14,16-20H,2-12,15,21-22H2,1H3
InChIKey YKGAHAJPZRZENW-UHFFFAOYSA-N
Mol Weight 382.6 g/mol
Molecular Formula C26H38O2
Exact Mass 382.28718 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3ZRWKLdgQVs
Name 1-Naphthaleneacetic acid, tetradecyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 382.287180462 u
Formula C26H38O2
InChI InChI=1S/C26H38O2/c1-2-3-4-5-6-7-8-9-10-11-12-15-21-28-26(27)22-24-19-16-18-23-17-13-14-20-25(23)24/h13-14,16-20H,2-12,15,21-22H2,1H3
InChIKey YKGAHAJPZRZENW-UHFFFAOYSA-N
Molecular Weight 382.588 g/mol
SMILES C1=CC2=C(C=C1)C(=CC=C2)CC(=O)OCCCCCCCCCCCCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.822011