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2-Anilino-4-phenyloctan-4-ol

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

2-Anilino-4-phenyloctan-4-ol
SpectraBase Compound ID 3XKsUu0e27C
InChI InChI=1S/C20H27NO/c1-3-4-15-20(22,18-11-7-5-8-12-18)16-17(2)21-19-13-9-6-10-14-19/h5-14,17,21-22H,3-4,15-16H2,1-2H3
InChIKey GOSLBWKSWSTDCW-UHFFFAOYSA-N
Mol Weight 297.44 g/mol
Molecular Formula C20H27NO
Exact Mass 297.209264 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9NBT03bKc3k
Name 2-Anilino-4-phenyloctan-4-ol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 297.209264492 u
Formula C20H27NO
InChI InChI=1S/C20H27NO/c1-3-4-15-20(22,18-11-7-5-8-12-18)16-17(2)21-19-13-9-6-10-14-19/h5-14,17,21-22H,3-4,15-16H2,1-2H3
InChIKey GOSLBWKSWSTDCW-UHFFFAOYSA-N
SMILES C(CC(NC1=CC=CC=C1)C)(C=1C=CC=CC1)(O)CCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.912404