(5aS,10bR)-2-Phenyl-4,5a,6,10b-tetrahydro-2H-indeno[2,1-b][1,2,4]triazolo[4,3-d][1,4]oxazin-11-ium tetrafluoroborate

Catalog Number	ACM463326741
CAS	463326-74-1
Synonyms	(1R,9S)-4-Phenyl-8-oxa-4,5-diaza-2-azoniatetracyclo[7.7.0.02,6.011,16]hexadeca-2,5,11,13,15-pentaene;tetrafluoroborate
IUPAC Name	(1R,9S)-4-phenyl-8-oxa-4,5-diaza-2-azoniatetracyclo[7.7.0.02,6.011,16]hexadeca-2,5,11,13,15-pentaene;trifluoroborane;fluoride
Molecular Weight	377.14
Molecular Formula	C18H16BF4N3O
InChI	XTKRWZGYQFUONZ-XCRQGQIYSA-M
InChI Key	InChI=1S/C18H16N3O.BF3.FH/c1-2-7-14(8-3-1)21-12-20-17(19-21)11-22-16-10-13-6-4-5-9-15(13)18(16)20;2-1(3)4;/h1-9,12,16,18H,10-11H2;;1H/q+1;;/p-1/t16-,18+;;/m0../s1
Melting Point	203-206 °C
Purity	98%
Isomeric SMILES	B(F)(F)F.C1[C@H]2[C@@H](C3=CC=CC=C31)[N+]4=CN(N=C4CO2)C5=CC=CC=C5.[F-]