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CXI

Summary
Name:2-(3-phenyloxetan-3-yl)ethanamine
Formula:C11 H15 N O
Formal charge:0
Formula weight:177.243 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.72-(3-phenyloxetan-3-yl)ethanamine

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C11H15NO/c12-7-6-11(8-13-9-11)10-4-2-1-3-5-10/h1-5H,6-9,12H2
InChIKeyInChI1.03WOFYQYBPLNLJAS-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385NCCC1(COC1)c2ccccc2
SMILESCACTVS3.385NCCC1(COC1)c2ccccc2
SMILES_CANONICALOpenEye OEToolkits2.0.7c1ccc(cc1)C2(COC2)CCN
SMILESOpenEye OEToolkits2.0.7c1ccc(cc1)C2(COC2)CCN

224201

數據於2024-08-28公開中

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