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N,N-Diethyl-1-(2,3-methylenedioxyphenyl)butan-2-amine

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N,N-Diethyl-1-(2,3-methylenedioxyphenyl)butan-2-amine
SpectraBase Compound ID ERgcuk2cxpD
InChI InChI=1S/C15H23NO2/c1-4-13(16(5-2)6-3)10-12-8-7-9-14-15(12)18-11-17-14/h7-9,13H,4-6,10-11H2,1-3H3
InChIKey MGGVRLLFOBYCOI-UHFFFAOYSA-N
Mol Weight 249.35 g/mol
Molecular Formula C15H23NO2
Exact Mass 249.172879 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID H6ghXFq3qRL
Name N,N-Diethyl-1-(2,3-methylenedioxyphenyl)butan-2-amine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 249.172878983 u
Formula C15H23NO2
InChI InChI=1S/C15H23NO2/c1-4-13(16(5-2)6-3)10-12-8-7-9-14-15(12)18-11-17-14/h7-9,13H,4-6,10-11H2,1-3H3
InChIKey MGGVRLLFOBYCOI-UHFFFAOYSA-N
Molecular Weight 249.354 g/mol
SMILES C=1(C2=C(OCO2)C=CC1)CC(N(CC)CC)CC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.926612