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4-piperidinaminium, N-[[3-(4-chlorophenoxy)-1-(2-methylphenyl)-4-oxo-2-azetidinyl]methyl]-1-(ethoxycarbonyl)-, chloride
SpectraBase Compound ID AOirqUt3uLJ
InChI InChI=1S/C25H30ClN3O4.ClH/c1-3-32-25(31)28-14-12-19(13-15-28)27-16-22-23(33-20-10-8-18(26)9-11-20)24(30)29(22)21-7-5-4-6-17(21)2;/h4-11,19,22-23,27H,3,12-16H2,1-2H3;1H
InChIKey BRCYWRBAHRBNOL-UHFFFAOYSA-N
Mol Weight 508.45 g/mol
Molecular Formula C25H31Cl2N3O4
Exact Mass 507.169162 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 313h6Yi2kCq
Name 4-piperidinaminium, N-[[3-(4-chlorophenoxy)-1-(2-methylphenyl)-4-oxo-2-azetidinyl]methyl]-1-(ethoxycarbonyl)-, 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 507.169161886 u
Formula C25H31Cl2N3O4
InChI InChI=1S/C25H30ClN3O4.ClH/c1-3-32-25(31)28-14-12-19(13-15-28)27-16-22-23(33-20-10-8-18(26)9-11-20)24(30)29(22)21-7-5-4-6-17(21)2;/h4-11,19,22-23,27H,3,12-16H2,1-2H3;1H
InChIKey BRCYWRBAHRBNOL-UHFFFAOYSA-N
Molecular Weight 508.446 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_5783
Solvent DMSO-d6
Source Vendor ID: NMR/12709130