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N-Phenyl-4-methylpyrrolidine-2-carbaldehyde;major

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 MS (GC)

N-Phenyl-4-methylpyrrolidine-2-carbaldehyde;major
SpectraBase Compound ID 8hNBZ3u5ObA
InChI InChI=1S/C12H15NO/c1-10-7-12(9-14)13(8-10)11-5-3-2-4-6-11/h2-6,9-10,12H,7-8H2,1H3
InChIKey ACKMJGIIARTPTM-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 30wJq0tacPY
Name N-Phenyl-4-methylpyrrolidine-2-carbaldehyde;major
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/c1-10-7-12(9-14)13(8-10)11-5-3-2-4-6-11/h2-6,9-10,12H,7-8H2,1H3
InChIKey ACKMJGIIARTPTM-UHFFFAOYSA-N
Molecular Weight 189.258 g/mol
SMILES C1(N(CC(C1)C)C1=CC=CC=C1)C=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.933833