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3-Methoxy-1,2,2a,5a,7-penta-aza-acenaphthylene-6 ,8(3H,7H)-dione
SpectraBase Compound ID LhFfwRdiPOb
InChI InChI=1S/C8H7N5O3/c1-16-4-2-3-12-7-5(10-11-13(4)7)6(14)9-8(12)15/h2-4H,1H3,(H,9,14,15)
InChIKey POGUBRLDDDCHDN-UHFFFAOYSA-N
Mol Weight 221.18 g/mol
Molecular Formula C8H7N5O3
Exact Mass 221.054889 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2Zr1cMXD78v
Name 3-Methoxy-1,2,2a,5a,7-penta-aza-acenaphthylene-6 ,8(3H,7H)-dione
CAS Registry Number 123417-43-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H7N5O3
InChI InChI=1S/C8H7N5O3/c1-16-4-2-3-12-7-5(10-11-13(4)7)6(14)9-8(12)15/h2-4H,1H3,(H,9,14,15)
InChIKey POGUBRLDDDCHDN-UHFFFAOYSA-N
Instrument Name Jeol FX-90
Literature Reference M. Jokic, V. Skaric, J. Chem. Soc. Perkin I 757 (1989).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6