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3-azabicyclo[3.3.1]non-6-ene-3-acetic acid, 6-chloro-1,5-dinitro-
SpectraBase Compound ID HpVNpsPu6BE
InChI InChI=1S/C10H12ClN3O6/c11-7-1-2-9(13(17)18)4-10(7,14(19)20)6-12(5-9)3-8(15)16/h1H,2-6H2,(H,15,16)
InChIKey NYIRDBZKDUVJMT-UHFFFAOYSA-N
Mol Weight 305.67 g/mol
Molecular Formula C10H12ClN3O6
Exact Mass 305.041463 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Cp57tyUWHS6
Name 3-azabicyclo[3.3.1]non-6-ene-3-acetic acid, 6-chloro-1,5-dinitro-
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C10H12ClN3O6/c11-7-1-2-9(13(17)18)4-10(7,14(19)20)6-12(5-9)3-8(15)16/h1H,2-6H2,(H,15,16)
InChIKey NYIRDBZKDUVJMT-UHFFFAOYSA-N
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_466
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: ZI/9040872; Labnumber: ATR-0000022