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(Q82939399)
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English
8-Methyl-8-azabicyclo[3.2.1]octan-3-yl cyclopentyl(hydroxy)phenylacetate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
343.214743788
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₂₉NO₃
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CN1C2CCC1CC(OC(=O)C(O)(c1ccccc1)C1CCCC1)C2
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C21H29NO3/c1-22-17-11-12-18(22)14-19(13-17)25-20(23)21(24,16-9-5-6-10-16)15-7-3-2-4-8-15/h2-4,7-8,16-19,24H,5-6,9-14H2,1H3
0 references
InChIKey
IPYJEAZSLJLQNG-UHFFFAOYSA-N
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CAS Registry Number
37830-19-6
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PubChem CID
169972
1 reference
matched by identifier from
InChIKey
InChIKey
IPYJEAZSLJLQNG-UHFFFAOYSA-N
DSSTox substance ID
DTXSID40958859
1 reference
matched by identifier from
InChIKey
InChIKey
IPYJEAZSLJLQNG-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID401386752
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