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(Q82657620)
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English
3-{[(2S)-Oxan-2-yl]oxy}pyrrolidine
group of stereoisomers with the chemical formula C₉H₁₇NO₂
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
171.125928784
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₉H₁₇NO₂
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
C1CCC(OC2CCNC2)OC1
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
C1CC[C@H](OC2CCNC2)OC1
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C9H17NO2/c1-2-6-11-9(3-1)12-8-4-5-10-7-8/h8-10H,1-7H2/t8?,9-/m0/s1
0 references
InChIKey
JCZDMBKPCOKANB-GKAPJAKFSA-N
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CAS Registry Number
204973-53-5
0 references
PubChem CID
56972048
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
63254401
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID30719315
0 references
DSSTOX compound identifier
DTXCID60670061
0 references
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