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7-(N-Propyl)amino-4-methylcoumarin

View entire compound with spectra: 1 FTIR

7-(N-Propyl)amino-4-methylcoumarin
SpectraBase Compound ID 2RttH7A0oQW
InChI InChI=1S/C13H15NO2/c1-3-6-14-10-4-5-11-9(2)7-13(15)16-12(11)8-10/h4-5,7-8,14H,3,6H2,1-2H3
InChIKey JQUUJFPXWBGOIQ-UHFFFAOYSA-N
Mol Weight 217.27 g/mol
Molecular Formula C13H15NO2
Exact Mass 217.110279 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2a4rsYK0KF4
Name 7-(N-Propyl)amino-4-methylcoumarin
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 217.110278725 u
Formula C13H15NO2
InChI InChI=1S/C13H15NO2/c1-3-6-14-10-4-5-11-9(2)7-13(15)16-12(11)8-10/h4-5,7-8,14H,3,6H2,1-2H3
InChIKey JQUUJFPXWBGOIQ-UHFFFAOYSA-N
Molecular Weight 217.268 g/mol
SMILES C1(=CC=C2C(=C1)OC(=O)C=C2C)NCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.890599