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D0M

Summary
Name:pentan-3-amine
Formula:C5 H13 N
Formal charge:0
Formula weight:87.163 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.01pentan-3-amine
OpenEye OEToolkits1.7.0pentan-3-amine

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01NC(CC)CC
SMILES_CANONICALCACTVS3.370CCC(N)CC
SMILESCACTVS3.370CCC(N)CC
SMILES_CANONICALOpenEye OEToolkits1.7.0CCC(CC)N
SMILESOpenEye OEToolkits1.7.0CCC(CC)N
InChIInChI1.03InChI=1S/C5H13N/c1-3-5(6)4-2/h5H,3-4,6H2,1-2H3
InChIKeyInChI1.03PQPFFKCJENSZKL-UHFFFAOYSA-N

227344

PDB entries from 2024-11-13

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