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3-{4'H-spiro[cyclohexane-1,3'-isoquinolin]-1'-yl}hexan-2-one
SpectraBase Compound ID K117f0vvAvG
InChI InChI=1S/C19H26N2O/c1-2-8-16(18(20)22)17-15-10-5-4-9-14(15)13-19(21-17)11-6-3-7-12-19/h4-5,9-10,16H,2-3,6-8,11-13H2,1H3,(H2,20,22)
InChIKey QMCLDAYMXJVDHJ-UHFFFAOYSA-N
Mol Weight 298.43 g/mol
Molecular Formula C19H26N2O
Exact Mass 298.204513 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ipd5WEhyPUd
Name 3-{4'H-spiro[cyclohexane-1,3'-isoquinolin]-1'-yl}hexan-2-one
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 298.204513464 u
Formula C19H26N2O
InChI InChI=1S/C19H26N2O/c1-2-8-16(18(20)22)17-15-10-5-4-9-14(15)13-19(21-17)11-6-3-7-12-19/h4-5,9-10,16H,2-3,6-8,11-13H2,1H3,(H2,20,22)
InChIKey QMCLDAYMXJVDHJ-UHFFFAOYSA-N
Molecular Weight 298.430 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_18317
Solvent DMSO-d6
Source Vendor ID: NMR/11270644; Lab Info: AJM; Lab Number: AJM-PeMi121