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2-piperidinone, 6-(6-chloro-1,3-benzodioxol-5-yl)-5-nitro-
SpectraBase Compound ID 6ymnYvle7QQ
InChI InChI=1S/C12H11ClN2O5/c13-7-4-10-9(19-5-20-10)3-6(7)12-8(15(17)18)1-2-11(16)14-12/h3-4,8,12H,1-2,5H2,(H,14,16)
InChIKey ISQNUCJEUYXRGA-UHFFFAOYSA-N
Mol Weight 298.68 g/mol
Molecular Formula C12H11ClN2O5
Exact Mass 298.035649 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6MN9TEBkoKm
Name 2-piperidinone, 6-(6-chloro-1,3-benzodioxol-5-yl)-5-nitro-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 298.035649157 u
Formula C12H11ClN2O5
InChI InChI=1S/C12H11ClN2O5/c13-7-4-10-9(19-5-20-10)3-6(7)12-8(15(17)18)1-2-11(16)14-12/h3-4,8,12H,1-2,5H2,(H,14,16)
InChIKey ISQNUCJEUYXRGA-UHFFFAOYSA-N
Molecular Weight 298.682 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_18085
Solvent DMSO-d6
Source Vendor ID: NMR/11270777; Lab Info: SAS; Lab Number: SAS-tst5052