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(Q82715194)
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English
2-tert-Butyl-4-methoxy-3,5-dinitrobenzaldehyde
chemical compound
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Statements
instance of
type of chemical entity
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subclass of
chemical compound
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mass
282.085186168
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₂H₁₄N₂O₆
0 references
canonical SMILES
CC(C)(C)C1=C(C(=C(C=C1C=O)[N+](=O)[O-])OC)[N+](=O)[O-]
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Identifiers
InChI
InChI=1S/C12H14N2O6/c1-12(2,3)9-7(6-15)5-8(13(16)17)11(20-4)10(9)14(18)19/h5-6H,1-4H3
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InChIKey
KBGHHGBOKIJJRX-UHFFFAOYSA-N
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CAS Registry Number
99758-81-3
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PubChem CID
71332173
1 reference
matched by identifier from
InChIKey
InChIKey
KBGHHGBOKIJJRX-UHFFFAOYSA-N
UniChem compound ID
64948284
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID50760667
1 reference
matched by identifier from
InChIKey
InChIKey
KBGHHGBOKIJJRX-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID30711410
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