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1-[1-(Phenylacetyl)-2-pyrrolidinyl]-acetone

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

1-[1-(Phenylacetyl)-2-pyrrolidinyl]-acetone
SpectraBase Compound ID LKv67fD0o91
InChI InChI=1S/C15H19NO2/c1-12(17)10-14-8-5-9-16(14)15(18)11-13-6-3-2-4-7-13/h2-4,6-7,14H,5,8-11H2,1H3
InChIKey JGPXXQDAJHVYLX-UHFFFAOYSA-N
Mol Weight 245.32 g/mol
Molecular Formula C15H19NO2
Exact Mass 245.141579 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BTse0atAE6J
Name 1-[1-(Phenylacetyl)-2-pyrrolidinyl]-acetone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 245.141578854 u
Formula C15H19NO2
InChI InChI=1S/C15H19NO2/c1-12(17)10-14-8-5-9-16(14)15(18)11-13-6-3-2-4-7-13/h2-4,6-7,14H,5,8-11H2,1H3
InChIKey JGPXXQDAJHVYLX-UHFFFAOYSA-N
Molecular Weight 245.322 g/mol
SMILES C1(N(CCC1)C(=O)CC1=CC=CC=C1)CC(=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.935456