Systematic / IUPAC Name: (1R,9S)-11-(1-Methylpiperidin-4-yl)-5-[4-(trifluoromethoxy)phenyl]-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one
ID: Reference8858
Other Names:
1,5-Methano-8H-pyrido[1,2-a][1,5]diazocin-8-one, 1,2,3,4,5,6-hexahydro-3-(1-methyl-4-piperidinyl)-9-[4-(trifluoromethoxy)phenyl]-, (1R,5S)-;
NAT11-286860
Formula: C24H28F3N3O2
(1R,9S)-11-(1-Methyl-4-piperidinyl)-5-[4-(trifluoromethoxy)phenyl]-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one 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 | 2 |
No. of Spectra | 534 |
Tandem Spectra | MS1, MS2, MS3 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 4/2/2024 7:59:21 AM |
InChI | InChI=1S/C24H28F3N3O2/c1-28-10-8-19(9-11-28)29-13-16-12-18(15-29)22-7-6-21(23(31)30(22)14-16)17-2-4-20(5-3-17)32-24(25,26)27/h2-7,16,18-19H,8-15H2,1H3/t16-,18+/m0/s1 |
InChI Key | YJDAMFYEVSXTSM-FUHWJXTLSA-N |
Canonical SMILES | CN1CCC(CC1)N2CC3CC(C2)C4=CC=C(C(=O)N4C3)C5=CC=C(C=C5)OC(F)(F)F |
CAS | |
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Other Names |
1,5-Methano-8H-pyrido[1,2-a][1,5]diazocin-8-one, 1,2,3,4,5,6-hexahydro-3-(1-methyl-4-piperidinyl)-9-[4-(trifluoromethoxy)phenyl]-, (1R,5S)-; NAT11-286860 |