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1-Ethanone, 2-phenyl-1-[1-(1-hydroxybutyl)cyclobutyl]

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

1-Ethanone, 2-phenyl-1-[1-(1-hydroxybutyl)cyclobutyl]
SpectraBase Compound ID 6Q0tip5ubb6
InChI InChI=1S/C16H22O2/c1-2-7-14(17)16(10-6-11-16)15(18)12-13-8-4-3-5-9-13/h3-5,8-9,14,17H,2,6-7,10-12H2,1H3
InChIKey GBRHMGCOESNYLV-UHFFFAOYSA-N
Mol Weight 246.35 g/mol
Molecular Formula C16H22O2
Exact Mass 246.16198 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FJYMFErIsC1
Name 1-Ethanone, 2-phenyl-1-[1-(1-hydroxybutyl)cyclobutyl]
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 246.161979946 u
Formula C16H22O2
InChI InChI=1S/C16H22O2/c1-2-7-14(17)16(10-6-11-16)15(18)12-13-8-4-3-5-9-13/h3-5,8-9,14,17H,2,6-7,10-12H2,1H3
InChIKey GBRHMGCOESNYLV-UHFFFAOYSA-N
Molecular Weight 246.350 g/mol
SMILES C(O)(CCC)C1(CCC1)C(CC1=CC=CC=C1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.811696