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Pentyl 4-(dimethylamino)benzoate

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

Pentyl 4-(dimethylamino)benzoate
SpectraBase Compound ID BHl8F9oXAWX
InChI InChI=1S/C14H21NO2/c1-4-5-6-11-17-14(16)12-7-9-13(10-8-12)15(2)3/h7-10H,4-6,11H2,1-3H3
InChIKey LXTZRIBXKVRLOA-UHFFFAOYSA-N
Mol Weight 235.33 g/mol
Molecular Formula C14H21NO2
Exact Mass 235.157229 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID EGm19gBV6kM
Name Pentyl 4-(dimethylamino)benzoate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 235.157228918 u
Formula C14H21NO2
InChI InChI=1S/C14H21NO2/c1-4-5-6-11-17-14(16)12-7-9-13(10-8-12)15(2)3/h7-10H,4-6,11H2,1-3H3
InChIKey LXTZRIBXKVRLOA-UHFFFAOYSA-N
Molecular Weight 235.327 g/mol
SMILES C(OCCCCC)(=O)C1=CC=C(C=C1)N(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.888684