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phenyl-[2-[[(1R)-1-phenylethyl]amino]-1-cyclopentenyl]methanone

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

phenyl-[2-[[(1R)-1-phenylethyl]amino]-1-cyclopentenyl]methanone
SpectraBase Compound ID D55ruiJtZJb
InChI InChI=1S/C20H21NO/c1-15(16-9-4-2-5-10-16)21-19-14-8-13-18(19)20(22)17-11-6-3-7-12-17/h2-7,9-12,15,21H,8,13-14H2,1H3/t15-/m1/s1
InChIKey XBMUJVFTVXYYLC-OAHLLOKOSA-N
Mol Weight 291.39 g/mol
Molecular Formula C20H21NO
Exact Mass 291.162314 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID D387EQWaYpS
Name Phenyl-[2-[[(1R)-1-phenylethyl]amino]-1-cyclopentenyl]methanone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 291.162314299 u
Formula C20H21NO
InChI InChI=1S/C20H21NO/c1-15(16-9-4-2-5-10-16)21-19-14-8-13-18(19)20(22)17-11-6-3-7-12-17/h2-7,9-12,15,21H,8,13-14H2,1H3/t15-/m1/s1
InChIKey XBMUJVFTVXYYLC-OAHLLOKOSA-N
SMILES C1(=C(N[C@@](C2=CC=CC=C2)(C)[H])CCC1)C(=O)C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.952699