N-({(2R,4S,5S)-5-[(Diethylamino)methyl]-1-azabicyclo[2.2.2]oct-2-yl}methyl)-4-(trifluoromethyl)benzamide

enlarge

Systematic / IUPAC Name: N-[[(2R,4S,5S)-5-(Diethylaminomethyl)-1-azabicyclo[2.2.2]octan-2-yl]methyl]-4-(trifluoromethyl)benzamide

ID: Reference10961

Other Names: Benzamide, N-[[(2R,4S,5S)-5-[(diethylamino)methyl]-1-azabicyclo[2.2.2]oct-2-yl]methyl]-4-(trifluoromethyl)-;
NAT13-339365

Formula: C21H30F3N3O

Spectral Data

N-({(2R,4S,5S)-5-[(Diethylamino)methyl]-1-azabicyclo[2.2.2]oct-2-yl}methyl)-4-(trifluoromethyl)benzamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 928
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 10/22/2021 6:19:22 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C21H30F3N3O/c1-3-26(4-2)13-17-14-27-10-9-16(17)11-19(27)12-25-20(28)15-5-7-18(8-6-15)21(22,23)24/h5-8,16-17,19H,3-4,9-14H2,1-2H3,(H,25,28)/t16-,17-,19+/m0/s1
InChI Key AIJGDFIPPIWACF-JENIJYKNSA-N
Canonical SMILES CCN(CC)CC1CN2CCC1CC2CNC(=O)C3=CC=C(C=C3)C(F)(F)F
CAS
Splash
Other Names Benzamide, N-[[(2R,4S,5S)-5-[(diethylamino)methyl]-1-azabicyclo[2.2.2]oct-2-yl]methyl]-4-(trifluoromethyl)-;
NAT13-339365

In Other Databases

PubChem 25389141
ChemSpider 21381307