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2,6-Diamino-3-methyl-5-nitrosopyrimidin-4(3H)-one - hydrate
SpectraBase Compound ID HVOjFMEvxmh
InChI InChI=1S/C5H7N5O2.H2O/c1-10-4(11)2(9-12)3(6)8-5(10)7;/h6H2,1H3,(H2,7,8);1H2
InChIKey JEUCHKXZONJVJT-UHFFFAOYSA-N
Mol Weight 187.16 g/mol
Molecular Formula C5H9N5O3
Exact Mass 187.070539 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IR5xvffTeST
Name 2,6-Diamino-3-methyl-5-nitrosopyrimidin-4(3H)-one - hydrate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H9N5O3
InChI InChI=1S/C5H7N5O2.H2O/c1-10-4(11)2(9-12)3(6)8-5(10)7;/h6H2,1H3,(H2,7,8);1H2
InChIKey JEUCHKXZONJVJT-UHFFFAOYSA-N
Molecular Weight 187.159 g/mol
SMILES O.NC1=C(C(N(C(=N1)N)C)=O)N=O
SPLASH splash10-0006-9100000000-f11e8c8dd193617dda03
Source of Spectrum Y-39-101-3
Wiley ID 1528316