BMRB

Biological Magnetic Resonance Data Bank


A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
Member of WWPDB

N-methylurea

Graphical representations:

N-methylurea image

Molecular Formula: C2 H6 N2 O

Natural Isotopic Abundance Mass: 74.08184

Mono-Isotopic Molecular Masses:

  • C12N14: 74.0480128251
  • C13N14: 76.0547225007
  • C12N15: 76.0420826115
  • C13N15: 78.0487922871

InCHi String:

canonical and isomeric SMILES: CNC(=O)N

PUBCHEM iupac NAME: PUBCHEM iupac TRADITIONAL NAME: PUBCHEM iupac OPENEYE NAME: PUBCHEM iupac CAS NAME
methylurea

PUBCHEM iupac SYSTEMATIC NAME
1-methylurea

PubChem Substance (SID):   111677869   21317904   47205671
PubChem Compound (CID):   11719
KEGG: Compound ID   C16363
CAS Registry IDs:   598-50-5
PDB Chemical Component   NMU
Miscellaneous Databases and IDs:   NMRShiftDB 20025572   UM-BBD c1176   MMCD cq_014627   MDL MFCD00007950

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.