BMRB

Biological Magnetic Resonance Data Bank


A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
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Lignin_cw_compound_264

Lignin_cw_compound_264 synonyms

alpha,4-dihydroxy-3-methoxypropiophenone

Wikipedia:

Graphical representations:

lignin_cw_compound_264 image

Molecular Formula: C10 H12 O4

Natural Isotopic Abundance Mass: 196.19988

Mono-Isotopic Molecular Masses:

  • C12N14: 196.0735588736
  • C13N14: 206.1071072516
  • C12N15: 196.0735588736
  • C13N15: 206.1071072516

InCHi String: InChI=1/C10H12O4/c1-6(11)10(13)7-3-4-8(12)9(5-7)14-2/h3-6,11-12H,1-2H3

Canonical and Isomeric SMILES: CC(C(C1=CC(=C(C=C1)O)OC)=O)O

Beilstein
alpha,4-dihydroxy-3-methoxypropiophenone

PubChem Substance (SID):   n/a
PubChem Compound (CID):   n/a
KEGG: Compound ID   n/a
CAS Registry IDs:   n/a
PDB Chemical Component   n/a
NMR Lignin Database 264
Miscellaneous Databases and IDs:   n/a

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.