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(R)-1-(N-phenylamino)-1-(4-tolyl)hexan-3-one

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

(R)-1-(N-phenylamino)-1-(4-tolyl)hexan-3-one
SpectraBase Compound ID 8QJw8Zu5erA
InChI InChI=1S/C19H23NO/c1-3-7-18(21)14-19(16-12-10-15(2)11-13-16)20-17-8-5-4-6-9-17/h4-6,8-13,19-20H,3,7,14H2,1-2H3/t19-/m1/s1
InChIKey YZYAJKYGBOVSQR-LJQANCHMSA-N
Mol Weight 281.4 g/mol
Molecular Formula C19H23NO
Exact Mass 281.177964 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CNmgxooxBfj
Name (R)-1-(N-Phenylamino)-1-(4-tolyl)hexan-3-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 281.177964364 u
Formula C19H23NO
InChI InChI=1S/C19H23NO/c1-3-7-18(21)14-19(16-12-10-15(2)11-13-16)20-17-8-5-4-6-9-17/h4-6,8-13,19-20H,3,7,14H2,1-2H3/t19-/m1/s1
InChIKey YZYAJKYGBOVSQR-LJQANCHMSA-N
SMILES C(C(=O)C[C@@](NC1=CC=CC=C1)(C1=CC=C(C=C1)C)[H])CC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.929348