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(Q72468118)
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English
3,4-Dimethoxy-5-nitrobenzaldehyde
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
211.048072388
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₉H₉NO₅
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canonical SMILES
COC1=C(C(=C(C=C1)C=O)[N+](=O)[O-])OC
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Identifiers
InChI
InChI=1S/C9H9NO5/c1-14-7-4-3-6(5-11)8(10(12)13)9(7)15-2/h3-5H,1-2H3
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InChIKey
VHXOKHNXAGVMJI-UHFFFAOYSA-N
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CAS Registry Number
22027-96-9
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PubChem CID
152437
1 reference
matched by identifier from
InChIKey
InChIKey
VHXOKHNXAGVMJI-UHFFFAOYSA-N
UniChem compound ID
12530534
1 reference
stated in
UniChem
NMRShiftDB structure ID
20026115
1 reference
matched by identifier from
InChIKey
InChIKey
VHXOKHNXAGVMJI-UHFFFAOYSA-N
DSSTox substance ID
DTXSID00944632
1 reference
matched by identifier from
InChIKey
InChIKey
VHXOKHNXAGVMJI-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID701372972
0 references
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