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(Q83016822)
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English
3-(2'-Phenyl-2'-cyclopentyl-2'-hydroxyethoxy)quinuclidine
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
315.219829168
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₂₀H₂₉NO₂
0 references
canonical SMILES
OC(COC1CN2CCC1CC2)(c1ccccc1)C1CCCC1
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
C1CCC(C1)[C@](CO[C@H]2CN3CCC2CC3)(C4=CC=CC=C4)O
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Identifiers
InChI
InChI=1S/C20H29NO2/c22-20(18-8-4-5-9-18,17-6-2-1-3-7-17)15-23-19-14-21-12-10-16(19)11-13-21/h1-3,6-7,16,18-19,22H,4-5,8-15H2/t19-,20-/m0/s1
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InChIKey
GTKRIWMDLNOSLI-PMACEKPBSA-N
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CAS Registry Number
114121-68-5
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PubChem CID
204064
1 reference
matched by identifier from
InChIKey
InChIKey
GTKRIWMDLNOSLI-PMACEKPBSA-N
UniChem compound ID
33497279
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID20150657
1 reference
matched by identifier from
InChIKey
InChIKey
GTKRIWMDLNOSLI-PMACEKPBSA-N
DSSTOX compound identifier
DTXCID2073148
0 references
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