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5H-2,3,4a,6,7a-Pentaazacyclopent[cd]indene-6(7H)-hexanoic acid,hexahydro-1,4-dioxo-
SpectraBase Compound ID 3s4RrZvOiZd
InChI InChI=1S/C12H19N5O4/c18-8(19)4-2-1-3-5-15-6-16-10-9(13-11(16)20)14-12(21)17(10)7-15/h9-10H,1-7H2,(H,13,20)(H,14,21)(H,18,19)
InChIKey ZPHHASKZLJLWQP-UHFFFAOYSA-N
Mol Weight 297.31 g/mol
Molecular Formula C12H19N5O4
Exact Mass 297.143704 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Bt0yBbs7i7N
Name 5H-2,3,4a,6,7a-Pentaazacyclopent[cd]indene-6(7H)-hexanoic acid,hexahydro-1,4-dioxo-
CAS Registry Number 117732-85-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H19N5O4
InChI InChI=1S/C12H19N5O4/c18-8(19)4-2-1-3-5-15-6-16-10-9(13-11(16)20)14-12(21)17(10)7-15/h9-10H,1-7H2,(H,13,20)(H,14,21)(H,18,19)
InChIKey ZPHHASKZLJLWQP-UHFFFAOYSA-N
Instrument Name Bruker AM-270
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6