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2-Pyrrolidino-4'-methoxyacetophenone

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

2-Pyrrolidino-4'-methoxyacetophenone
SpectraBase Compound ID 9Zctm7embxm
InChI InChI=1S/C13H17NO2/c1-16-12-6-4-11(5-7-12)13(15)10-14-8-2-3-9-14/h4-7H,2-3,8-10H2,1H3
InChIKey QETPKNUGDGIITI-UHFFFAOYSA-N
Mol Weight 219.28 g/mol
Molecular Formula C13H17NO2
Exact Mass 219.125929 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID EF8lFr03aGr
Name 2-Pyrrolidino-4'-methoxyacetophenone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 219.125928789 u
Formula C13H17NO2
InChI InChI=1S/C13H17NO2/c1-16-12-6-4-11(5-7-12)13(15)10-14-8-2-3-9-14/h4-7H,2-3,8-10H2,1H3
InChIKey QETPKNUGDGIITI-UHFFFAOYSA-N
Molecular Weight 219.284 g/mol
SMILES C=1(C(CN2CCCC2)=O)C=CC(=CC1)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.85024