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VOE

Summary
Name:(2R)-2-phenylbutan-1-amine
Formula:C10 H15 N
Formal charge:0
Formula weight:149.233 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.01(2R)-2-phenylbutan-1-amine
OpenEye OEToolkits2.0.7(2~{R})-2-phenylbutan-1-amine

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01NCC(CC)c1ccccc1
InChIInChI1.06InChI=1S/C10H15N/c1-2-9(8-11)10-6-4-3-5-7-10/h3-7,9H,2,8,11H2,1H3/t9-/m0/s1
InChIKeyInChI1.06PLWALTDUYKDGRF-VIFPVBQESA-N
SMILES_CANONICALCACTVS3.385CC[C@@H](CN)c1ccccc1
SMILESCACTVS3.385CC[CH](CN)c1ccccc1
SMILES_CANONICALOpenEye OEToolkits2.0.7CC[C@@H](CN)c1ccccc1
SMILESOpenEye OEToolkits2.0.7CCC(CN)c1ccccc1

222415

PDB entries from 2024-07-10

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