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Creatinine
SpectraBase Compound ID 8LXprxLhOYK
InChI InChI=1S/C4H7N3O/c1-7-2-3(8)6-4(7)5/h2H2,1H3,(H2,5,6,8)
InChIKey DDRJAANPRJIHGJ-UHFFFAOYSA-N
Mol Weight 113.12 g/mol
Molecular Formula C4H7N3O
Exact Mass 113.058912 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E7XvQyV9it1
Name
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C4H7N3O
InChI InChI=1S/C4H7N3O/c1-7-2-3(8)6-4(7)5/h2H2,1H3,(H2,5,6,8)
InChIKey DDRJAANPRJIHGJ-UHFFFAOYSA-N
Molecular Weight 113.0588
SMILES N=C1N(C)CC(=O)N1
SPLASH splash10-01ox-9400000000-ec5d7c88d5036e3602a6
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany