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5-Hydroxy-7-oxo-3-propyl-6-aza-bicyclo[3.2.1]octane-1,2,2-tricarbonitrile
SpectraBase Compound ID Cnkt1l57egO
InChI InChI=1S/C13H14N4O2/c1-2-3-9-4-13(19)5-11(6-14,10(18)17-13)12(9,7-15)8-16/h9,19H,2-5H2,1H3,(H,17,18)
InChIKey VNMZDLQMJGAUBM-UHFFFAOYSA-N
Mol Weight 258.28 g/mol
Molecular Formula C13H14N4O2
Exact Mass 258.111676 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9H6Amp291MT
Name 6-azabicyclo[3.2.1]octane-1,2,2-tricarbonitrile, 5-hydroxy-7-oxo-3-propyl-
Copyright Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 258.111675705 u
Formula C13H14N4O2
InChI InChI=1S/C13H14N4O2/c1-2-3-9-4-13(19)5-11(6-14,10(18)17-13)12(9,7-15)8-16/h9,19H,2-5H2,1H3,(H,17,18)
InChIKey VNMZDLQMJGAUBM-UHFFFAOYSA-N
Molecular Weight 258.281 g/mol
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_5171
Solvent DMSO-d6
Source Vendor ID: NMR/9264892; Lab Info: Cheb; Lab Number: Cheb-L000012
Temperature 23.85 °C