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3'-Methoxy-2-(N-methyl,N-propylamino)acetophenone
SpectraBase Compound ID 2IJWve0epoi
InChI InChI=1S/C13H19NO2/c1-4-8-14(2)10-13(15)11-6-5-7-12(9-11)16-3/h5-7,9H,4,8,10H2,1-3H3
InChIKey USKUKVVAZBUQCQ-UHFFFAOYSA-N
Mol Weight 221.3 g/mol
Molecular Formula C13H19NO2
Exact Mass 221.141579 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2WvQaEhxGHb
Name 3'-Methoxy-2-(N-methyl,N-propylamino)acetophenone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 221.141578854 u
Formula C13H19NO2
InChI InChI=1S/C13H19NO2/c1-4-8-14(2)10-13(15)11-6-5-7-12(9-11)16-3/h5-7,9H,4,8,10H2,1-3H3
InChIKey USKUKVVAZBUQCQ-UHFFFAOYSA-N
Molecular Weight 221.300 g/mol
SMILES C=1(C(CN(CCC)C)=O)C=C(C=CC1)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.889045