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(Q82004133)
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English
3-ethyl-2-methyl-1,3-benzoxazol-3-ium
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
162.09134042409
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₀H₁₂NO⁺
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CC[N+]1=C(OC2=CC=CC=C21)C
0 references
Identifiers
InChI
InChI=1S/C10H12NO/c1-3-11-8(2)12-10-7-5-4-6-9(10)11/h4-7H,3H2,1-2H3/q+1
0 references
InChIKey
PAWXTPSQTMYBSB-UHFFFAOYSA-N
0 references
CAS Registry Number
42846-14-0
0 references
PubChem CID
21332
1 reference
matched by identifier from
InChIKey
InChIKey
PAWXTPSQTMYBSB-UHFFFAOYSA-N
SureChEMBL ID
SCHEMBL1046351
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
PAWXTPSQTMYBSB-UHFFFAOYSA-N
UniChem compound ID
15061974
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID20274701
1 reference
matched by identifier from
InChIKey
InChIKey
PAWXTPSQTMYBSB-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID20197880
0 references
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