Synonyms: "2-acetyl-5-tert-butyl-4,6-dinitroxylene", "ketone moschus", "1-(4-tert-butyl-2,6-dimethyl-3,5-dinitrophenyl)ethanone"
Source: musk ketone is a widely used artificial fragrance which has been identified in human fatty tissue and milk.
IUPAC Name: 1-(4-tert-butyl-2,6-dimethyl-3,5-dinitrophenyl)ethanone
CAS Number: 81-14-1
PubChem ID: 6669
Canonical SMILES: CC1=C(C(=C(C(=C1[N+](=O)[O-])C(C)(C)C)[N+](=O)[O-])C)C(=O)C
Molecular Formula: C14H18N2O5
Molecular Weight: 294,3031
Number of bond donors: 0
Number of bond acceptors: 5
Number of atoms different from hydrogen: 21
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