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(Q82098690)
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English
ISOPROPYL ISONICOTINATE
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
165.078978592
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₉H₁₁NO₂
0 references
canonical SMILES
CC(C)OC(=O)C1=CC=NC=C1
0 references
Identifiers
InChI
InChI=1S/C9H11NO2/c1-7(2)12-9(11)8-3-5-10-6-4-8/h3-7H,1-2H3
0 references
InChIKey
FBDVYRNKUYCAGB-UHFFFAOYSA-N
0 references
CAS Registry Number
125294-42-0
0 references
PubChem CID
504307
1 reference
matched by identifier from
InChIKey
InChIKey
FBDVYRNKUYCAGB-UHFFFAOYSA-N
SureChEMBL ID
SCHEMBL552612
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
FBDVYRNKUYCAGB-UHFFFAOYSA-N
UniChem compound ID
26334711
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60333427
1 reference
matched by identifier from
InChIKey
InChIKey
FBDVYRNKUYCAGB-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID70284517
0 references
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