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2-Amino-6-(5-aminopentylamino)-5-nitro-1H-pyrimidin-4-one
SpectraBase Compound ID CcJUbOpKX0D
InChI InChI=1S/C9H16N6O3/c10-4-2-1-3-5-12-7-6(15(17)18)8(16)14-9(11)13-7/h1-5,10H2,(H4,11,12,13,14,16)
InChIKey OUJKCVJCMLEMSO-UHFFFAOYSA-N
Mol Weight 256.27 g/mol
Molecular Formula C9H16N6O3
Exact Mass 256.128388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 43TBPfs2xSJ
Name 2-Amino-6-(5-aminopentylamino)-5-nitro-1H-pyrimidin-4-one
CAS Registry Number 103061-95-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16N6O3
InChI InChI=1S/C9H16N6O3/c10-4-2-1-3-5-12-7-6(15(17)18)8(16)14-9(11)13-7/h1-5,10H2,(H4,11,12,13,14,16)
InChIKey OUJKCVJCMLEMSO-UHFFFAOYSA-N
Molecular Weight 256.266 g/mol
SMILES N1C(=NC(C(=C1NCCCCCN)N(=O)=O)=O)N
SPLASH splash10-0a4i-0090000000-741223b371994227e3d9
Source of Spectrum Y-22-1039-15
Synonyms 2-Azanyl-6-(5-azanylpentylamino)-5-nitro-1H-pyrimidin-4-one
Wiley ID 1259186