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2-ethylhexanoate; piperidin-1-ium

2-ethylhexanoate; piperidin-1-ium

Systemtic Name:2-ethylhexanoate; piperidin-1-ium
Openeye Name:2-ethylhexanoate; piperidin-1-ium
CAS Name:2-ethylhexanoate; piperidin-1-ium
IUPAC Name:2-ethylhexanoate; piperidin-1-ium
Traditional Name:2-ethylhexanoate; piperidin-1-ium
Formula: C13H27NO2
MolecularWeight: 229.35898
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)[O-].C1CC[NH2+]CC1


Isomeric SMILES

CCCCC(CC)C(=O)[O-].C1CC[NH2+]CC1


InChI

InChI=1S/C8H16O2.C5H11N/c1-3-5-6-7(4-2)8(9)10;1-2-4-6-5-3-1/h7H,3-6H2,1-2H3,(H,9,10);6H,1-5H2


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