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4-Isopropylphenylcarbamic acid, ethyl ester

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

4-Isopropylphenylcarbamic acid, ethyl ester
SpectraBase Compound ID CgkWJ5YOdR5
InChI InChI=1S/C12H17NO2/c1-4-15-12(14)13-11-7-5-10(6-8-11)9(2)3/h5-9H,4H2,1-3H3,(H,13,14)
InChIKey NDZLWZWWMFITRY-UHFFFAOYSA-N
Mol Weight 207.27 g/mol
Molecular Formula C12H17NO2
Exact Mass 207.125929 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JXKZeU2jPWr
Name 4-Isopropylphenylcarbamic acid, ethyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 207.125928789 u
Formula C12H17NO2
InChI InChI=1S/C12H17NO2/c1-4-15-12(14)13-11-7-5-10(6-8-11)9(2)3/h5-9H,4H2,1-3H3,(H,13,14)
InChIKey NDZLWZWWMFITRY-UHFFFAOYSA-N
Molecular Weight 207.273 g/mol
SMILES C1=C(C=CC(=C1)NC(=O)OCC)C(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.966429