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BBKWLOSKDZKXAF-UHFFFAOYSA-N

View entire compound with spectra: 1 NMR

BBKWLOSKDZKXAF-UHFFFAOYSA-N
SpectraBase Compound ID CDqfgWdXDPC
InChI InChI=1S/C12H17N5O3/c1-2-3-9(19)20-5-8(18)4-17-7-16-10-11(13)14-6-15-12(10)17/h6-8,18H,2-5H2,1H3,(H2,13,14,15)
InChIKey BBKWLOSKDZKXAF-UHFFFAOYSA-N
Mol Weight 279.3 g/mol
Molecular Formula C12H17N5O3
Exact Mass 279.133139 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IXMns2sQDsQ
Name BBKWLOSKDZKXAF-UHFFFAOYSA-N
Compound Number 2B
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H17N5O3
InChI InChI=1S/C12H17N5O3/c1-2-3-9(19)20-5-8(18)4-17-7-16-10-11(13)14-6-15-12(10)17/h6-8,18H,2-5H2,1H3,(H2,13,14,15)
InChIKey BBKWLOSKDZKXAF-UHFFFAOYSA-N
Literature Reference Author J.BRABCOVA,J.BLAZEK,L.JANSKA,M.KRECMEROVA,M.ZAREVUCKA
Literature Reference Citation MOLECULES,17,13813(2012)
Literature Reference DOI 10.3390/molecules171213813
Molecular Weight 279.299 g/mol
Sample ID 1608
Solvent DMSO-D6