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(Q82042140)
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English
N-[(2H-1,3-Benzodioxol-5-yl)methyl]propan-2-amine
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
193.11027872
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₁H₁₅NO₂
0 references
canonical SMILES
CC(C)NCC1=CC2=C(C=C1)OCO2
0 references
Identifiers
InChI
InChI=1S/C11H15NO2/c1-8(2)12-6-9-3-4-10-11(5-9)14-7-13-10/h3-5,8,12H,6-7H2,1-2H3
0 references
InChIKey
WHKUSTNUIKQFLL-UHFFFAOYSA-N
0 references
CAS Registry Number
68291-92-9
0 references
PubChem CID
280251
1 reference
matched by identifier from
InChIKey
InChIKey
WHKUSTNUIKQFLL-UHFFFAOYSA-N
SureChEMBL ID
SCHEMBL1099886
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
WHKUSTNUIKQFLL-UHFFFAOYSA-N
UniChem compound ID
24779573
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID90299643
1 reference
matched by identifier from
InChIKey
InChIKey
WHKUSTNUIKQFLL-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID80206189
0 references
NSC number
131714
0 references
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