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(Q82713659)
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English
But-2-enedioic acid--2-methyl-1H-imidazole (1/1)
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
198.0640568
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₈H₁₀N₂O₄
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
Cc1ncc[nH]1.O=C(O)C=CC(=O)O
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C4H6N2.C4H4O4/c1-4-5-2-3-6-4;5-3(6)1-2-4(7)8/h2-3H,1H3,(H,5,6);1-2H,(H,5,6)(H,7,8)
0 references
InChIKey
UCULZUOAPNTDHO-UHFFFAOYSA-N
0 references
CAS Registry Number
95414-93-0
0 references
PubChem CID
71330873
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
UCULZUOAPNTDHO-UHFFFAOYSA-N
UniChem compound ID
49520103
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID40759520
1 reference
matched by identifier from
InChIKey
InChIKey
UCULZUOAPNTDHO-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID50710263
0 references
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