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1,2,5-oxadiazole-3-carboxamide, 4-amino-N-[2-[(3-chloro-2-methyl-4,6-dinitrophenyl)amino]ethyl]-
SpectraBase Compound ID BYeKsaFkzue
InChI InChI=1S/C12H12ClN7O6/c1-5-8(13)6(19(22)23)4-7(20(24)25)9(5)15-2-3-16-12(21)10-11(14)18-26-17-10/h4,15H,2-3H2,1H3,(H2,14,18)(H,16,21)
InChIKey GDWSWJBMLYFMPQ-UHFFFAOYSA-N
Mol Weight 385.72 g/mol
Molecular Formula C12H12ClN7O6
Exact Mass 385.053759 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9mpPMFXzSMP
Name 1,2,5-oxadiazole-3-carboxamide, 4-amino-N-[2-[(3-chloro-2-methyl-4,6-dinitrophenyl)amino]ethyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 385.053758828 u
Formula C12H12ClN7O6
InChI InChI=1S/C12H12ClN7O6/c1-5-8(13)6(19(22)23)4-7(20(24)25)9(5)15-2-3-16-12(21)10-11(14)18-26-17-10/h4,15H,2-3H2,1H3,(H2,14,18)(H,16,21)
InChIKey GDWSWJBMLYFMPQ-UHFFFAOYSA-N
Molecular Weight 385.724 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_4887
Solvent DMSO-d6
Source Vendor ID: NMR/10210086; Lab Info: LP; Lab Number: 25-871