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Basic information
- CAS
110964-35-7- Standard SMILES
CC(C)(C)C(=O)C(C#N)=C(O)c1ccc(Cl)cc1[N+](=O)[O-]- InChIKey
VURHSZKCSQPMBM-UHFFFAOYSA-N- Molecular formula
- C14H13ClN2O4
- Average molar mass
- 308.721 g/mol
- Monoisotopic mass
- 308.05638458
Names & identifiers
- Preferred name
- Pentanenitrile, 2-[(4-chloro-2-nitrophenyl)hydroxymethylene]-4,4-dimethyl-3-oxo-
- IUPAC
- 2-[(4-Chloro-2-nitrophenyl)(hydroxy)methylidene]-4,4-dimethyl-3-oxopentanenitrile
Database identifiers
- CAS
110964-35-7- PubChem CID
- 183149
- DTXSID
DTXSID0073792
Related reactions
3 records
Compound notes
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