CHEBI:46490 - 2,3-DIMETHYL-BUTYRALDEHYDE

ChEBI IDCHEBI:46490
ChEBI Name2,3-DIMETHYL-BUTYRALDEHYDE
Stars
DownloadsMolfile
FormulaC6H12O
Net Charge0
Average Mass100.161
Monoisotopic Mass100.08882
SMILES[H]C(=O)[C@@]([H])(C([H])([H])[H])C([H])(C([H])([H])[H])C([H])([H])[H]
InChIInChI=1S/C6H12O/c1-5(2)6(3)4-7/h4-6H,1-3H3/t6-/m1/s1
InChIKeyAKUUEDVRXOZTBF-ZCFIWIBFSA-N
ChEBI Ontology
Outgoing Relation(s)
2,3-DIMETHYL-BUTYRALDEHYDE (CHEBI:46490) is a unclassifieds (CHEBI:27189)
Synonyms  Source
2,3-DIMETHYL-BUTYRALDEHYDEPDBeChem
(2S)-2,3-dimethylbutanalPDBeChem
Manual XrefsDatabases
VASPDBeChem