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2-azetidinemethanaminium, 3-(4-chlorophenoxy)-N-cyclopentyl-1-(2-methylphenyl)-4-oxo-, chloride
SpectraBase Compound ID 1uqlnD2DXd6
InChI InChI=1S/C22H25ClN2O2.ClH/c1-15-6-2-5-9-19(15)25-20(14-24-17-7-3-4-8-17)21(22(25)26)27-18-12-10-16(23)11-13-18;/h2,5-6,9-13,17,20-21,24H,3-4,7-8,14H2,1H3;1H
InChIKey BTSGORASQDZNHS-UHFFFAOYSA-N
Mol Weight 421.37 g/mol
Molecular Formula C22H26Cl2N2O2
Exact Mass 420.137133 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CfhlLCA1rGf
Name 2-azetidinemethanaminium, 3-(4-chlorophenoxy)-N-cyclopentyl-1-(2-methylphenyl)-4-oxo-, chloride
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 420.137133483 u
Formula C22H26Cl2N2O2
InChI InChI=1S/C22H25ClN2O2.ClH/c1-15-6-2-5-9-19(15)25-20(14-24-17-7-3-4-8-17)21(22(25)26)27-18-12-10-16(23)11-13-18;/h2,5-6,9-13,17,20-21,24H,3-4,7-8,14H2,1H3;1H
InChIKey BTSGORASQDZNHS-UHFFFAOYSA-N
Molecular Weight 421.368 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_4931
Solvent DMSO-d6
Source Vendor ID: NMR/12708624