1-Methyl-3-oxo-4-phenyl-1-azoniabicyclo[2.2.2]octane bromide
[CAS# 64755-06-2]

Identification

• Name: 1-Methyl-3-oxo-4-phenyl-1-azoniabicyclo[2.2.2]octane bromide
• Synonyms: 1-Azoniabicyclo(2.2.2)octane, 1-methyl-3-oxo-4-phenyl-, bromide; 1-AZONIABICYCLO(2.2.2)OCTANE, 1-METHYL-3-OXO-4-PHENYL-, BROMIDE, HEMIHDRATE; 1-Methyl-3-keto-4-phenylquinuclidinium bromide
• Molecular Formula: C₁₄H₁₈BrNO
• Molecular Weight: 296.20
• CAS Registry Number: 64755-06-2
• SMILES: C[N+]12CCC(CC1)(C(=O)C2)C3=CC=CC=C3.[Br-]
• InChI: 1S/C14H18NO.BrH/c1-15-9-7-14(8-10-15,13(16)11-15)12-5-3-2-4-6-12;/h2-6H,7-11H2,1H3;1H/q+1;/p-1
• InChIKey: YNUZUBWTAHVOFU-UHFFFAOYSA-M