Analyte Name

(S)-4,4-Dibutyl-2,6-bis(3,4,5-trifluorophenyl)-4,5-dihydro-3H-dinaphtho[2,1-c:1',2'-e]azepinium Bromide

CAS Number

851942-89-7

Molecular Formula

C42 H36 F6 N . Br

Molecular Weight

748.636

Accurate Mass

747.194

SMILES

[Br-].CCCC[N+]1(CCCC)Cc2c(cc3ccccc3c2c4c(C1)c(cc5ccccc45)c6cc(F)c(F)c(F)c6)c7cc(F)c(F)c(F)c7

InChI

InChI=1S/C42H36F6N.BrH/c1-3-5-15-49(16-6-4-2)23-33-31(27-19-35(43)41(47)36(44)20-27)17-25-11-7-9-13-29(25)39(33)40-30-14-10-8-12-26(30)18-32(34(40)24-49)28-21-37(45)42(48)38(46)22-28;/h7-14,17-22H,3-6,15-16,23-24H2,1-2H3;1H/q+1;/p-1

IUPAC

13,13-dibutyl-10,16-bis(3,4,5-trifluorophenyl)-13-azoniapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaene;bromide

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Synthesis Tools

Product Format

Neat