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1-octan-3-ylpyrazin-1-ium

1-octan-3-ylpyrazin-1-ium

Systemtic Name:1-octan-3-ylpyrazin-1-ium
Openeye Name:1-(1-ethylhexyl)pyrazin-1-ium
CAS Name:1-octan-3-ylpyrazin-1-ium
IUPAC Name:1-octan-3-ylpyrazin-1-ium
Traditional Name:1-(1-ethylhexyl)pyrazin-1-ium
Formula: C12H21N2+
MolecularWeight: 193.30854
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)[N+]1=CC=NC=C1


Isomeric SMILES

CCCCCC(CC)[N+]1=CC=NC=C1


InChI

InChI=1S/C12H21N2/c1-3-5-6-7-12(4-2)14-10-8-13-9-11-14/h8-12H,3-7H2,1-2H3/q+1


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