Systematic / IUPAC Name: (3R,4R,6R)-6-[[4-(1-Hydroxycyclopentyl)triazol-1-yl]methyl]-N-[(2-methoxyphenyl)methyl]-1-azabicyclo[2.2.2]octane-3-carboxamide
ID: Reference8881
Other Names:
1-Azabicyclo[2.2.2]octane-3-carboxamide, 6-[[4-(1-hydroxycyclopentyl)-1H-1,2,3-triazol-1-yl]methyl]-N-[(2-methoxyphenyl)methyl]-, (3R,4R,6R)-;
NAT13-328857
Formula: C24H33N5O3
(3R,4R,6R)-6-{[4-(1-Hydroxycyclopentyl)-1H-1,2,3-triazol-1-yl]methyl}-N-(2-methoxybenzyl)quinuclidine-3-carboxamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Orbitrap Fusion Lumos with ETD LBP FAIMS |
No. of Spectral Trees | 1 |
No. of Spectra | 1827 |
Tandem Spectra | MS1, MS2, MS3, MS4, MS5 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 9/2/2019 7:34:52 AM |
InChI | InChI=1S/C24H33N5O3/c1-32-21-7-3-2-6-18(21)13-25-23(30)20-15-28-11-8-17(20)12-19(28)14-29-16-22(26-27-29)24(31)9-4-5-10-24/h2-3,6-7,16-17,19-20,31H,4-5,8-15H2,1H3,(H,25,30)/t17-,19-,20+/m1/s1 |
InChI Key | BRWNLAZCMASSRZ-RLLQIKCJSA-N |
Canonical SMILES | COC1=CC=CC=C1CNC(=O)C2CN3CCC2CC3CN4C=C(N=N4)C5(CCCC5)O |
CAS | |
Splash | |
Other Names |
1-Azabicyclo[2.2.2]octane-3-carboxamide, 6-[[4-(1-hydroxycyclopentyl)-1H-1,2,3-triazol-1-yl]methyl]-N-[(2-methoxyphenyl)methyl]-, (3R,4R,6R)-; NAT13-328857 |