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1-Naphthaleneacetic acid, dodecyl ester

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

1-Naphthaleneacetic acid, dodecyl ester
SpectraBase Compound ID 7p4RAIXLXmb
InChI InChI=1S/C24H34O2/c1-2-3-4-5-6-7-8-9-10-13-19-26-24(25)20-22-17-14-16-21-15-11-12-18-23(21)22/h11-12,14-18H,2-10,13,19-20H2,1H3
InChIKey RCDIZPLHRKGGGM-UHFFFAOYSA-N
Mol Weight 354.5 g/mol
Molecular Formula C24H34O2
Exact Mass 354.25588 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FihYSUKxGlY
Name 1-Naphthaleneacetic acid, dodecyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 354.255880333 u
Formula C24H34O2
InChI InChI=1S/C24H34O2/c1-2-3-4-5-6-7-8-9-10-13-19-26-24(25)20-22-17-14-16-21-15-11-12-18-23(21)22/h11-12,14-18H,2-10,13,19-20H2,1H3
InChIKey RCDIZPLHRKGGGM-UHFFFAOYSA-N
Molecular Weight 354.534 g/mol
SMILES C1=CC2=C(C=C1)C(=CC=C2)CC(=O)OCCCCCCCCCCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.895216