CAS Registry Number®
97558-87-7
CAS Name
Hexanoic acid, 2-ethyl-, compd. with 1,4-diazabicyclo[2.2.2]octane (1:?)
Molecular Formula
C8H16O2.xC6H12N2
Other Names and Identifiers
InChI
InChI=1S/C8H16O2.C6H12N2/c1-3-5-6-7(4-2)8(9)10;1-2-8-5-3-7(1)4-6-8/h7H,3-6H2,1-2H3,(H,9,10);1-6H2
InChIKey
InChIKey=ODKVLQSZENFTOH-UHFFFAOYSA-N
SMILES
N12CCN(CC1)CC2.C(CCCC)(C(O)=O)CC
Canonical SMILES
O=C(O)C(CC)CCCC.N12CCN(CC1)CC2
Other Names for this Substance
- Hexanoic acid, 2-ethyl-, compd. with 1,4-diazabicyclo[2.2.2]octane (1:?)
- Hexanoic acid, 2-ethyl-, compd. with 1,4-diazabicyclo[2.2.2]octane
- 1,4-Diazabicyclo[2.2.2]octane, 2-ethylhexanoate
