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6-IMINO-1-(2-PYRROLIDIN-1-YL-ETHYL)-6,7-DIHYDRO-1H,5H-1,3,5,7-TETRAAZA-AZULENE-4,8-DIONE
SpectraBase Compound ID FX99bRUVdGP
InChI InChI=1S/C12H16N6O2/c13-12-15-10(19)8-9(11(20)16-12)18(7-14-8)6-5-17-3-1-2-4-17/h7H,1-6H2,(H3,13,15,16,19,20)
InChIKey OKTQBCUKQNFNTI-UHFFFAOYSA-N
Mol Weight 276.3 g/mol
Molecular Formula C12H16N6O2
Exact Mass 276.133474 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4qVm1kfVRtm
Name 6-IMINO-1-(2-PYRROLIDIN-1-YL-ETHYL)-6,7-DIHYDRO-1H,5H-1,3,5,7-TETRAAZA-AZULENE-4,8-DIONE
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H16N6O2
InChI InChI=1S/C12H16N6O2/c13-12-15-10(19)8-9(11(20)16-12)18(7-14-8)6-5-17-3-1-2-4-17/h7H,1-6H2,(H3,13,15,16,19,20)
InChIKey OKTQBCUKQNFNTI-UHFFFAOYSA-N
Literature Reference Author K.WITTINE,K.POLJAK,M.KOVAC,D.MAKUC,J.PLAVEC,J.BALZARINI,T.MA RTINOVIC,S.K.PAVELIC
Literature Reference Citation MOLECULES,18,13385(2013)
Literature Reference DOI 10.3390/molecules181113385
Molecular Weight 276.298 g/mol
Solvent DMSO-D6
Source File Reference UWIR9836