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UFZ

Summary
Name:(phenylmethyl)azanium
Formula:C7 H10 N
Formal charge:1
Formula weight:108.161 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.6(phenylmethyl)azanium

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C7H9N/c8-6-7-4-2-1-3-5-7/h1-5H,6,8H2/p+1
InChIKeyInChI1.03WGQKYBSKWIADBV-UHFFFAOYSA-O
SMILES_CANONICALCACTVS3.385[NH3+]Cc1ccccc1
SMILESCACTVS3.385[NH3+]Cc1ccccc1
SMILES_CANONICALOpenEye OEToolkits2.0.6c1ccc(cc1)C[NH3+]
SMILESOpenEye OEToolkits2.0.6c1ccc(cc1)C[NH3+]

217705

PDB entries from 2024-03-27

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