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5,5-Dimethyl-3-phenyl-pyrrolidin-2-one

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

5,5-Dimethyl-3-phenyl-pyrrolidin-2-one
SpectraBase Compound ID FOgi3fHdxQj
InChI InChI=1S/C12H15NO/c1-12(2)8-10(11(14)13-12)9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3,(H,13,14)
InChIKey QVXJARZDQKCUNB-UHFFFAOYSA-N
Mol Weight 189.26 g/mol
Molecular Formula C12H15NO
Exact Mass 189.115364 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3xlGPJxGobR
Name 5,5-Dimethyl-3-phenyl-pyrrolidin-2-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 189.115364106 u
Formula C12H15NO
InChI InChI=1S/C12H15NO/c1-12(2)8-10(11(14)13-12)9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3,(H,13,14)
InChIKey QVXJARZDQKCUNB-UHFFFAOYSA-N
Molecular Weight 189.258 g/mol
SMILES C1(NC(CC1C1=CC=CC=C1)(C)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.971574