(1R,9S)-11-(2-Pyrazinylcarbonyl)-3-[4-(trifluoromethoxy)phenyl]-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one

Systematic / IUPAC Name: (1R,9S)-11-(Pyrazine-2-carbonyl)-3-[4-(trifluoromethoxy)phenyl]-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one

ID: Reference10156

Other Names: 1,5-Methano-8H-pyrido[1,2-a][1,5]diazocin-8-one, 1,2,3,4,5,6-hexahydro-3-(2-pyrazinylcarbonyl)-11-[4-(trifluoromethoxy)phenyl]-, (1R,5S)-;
NAT11-288276

Formula: C23H19F3N4O3

Spectral Data

(1R,9S)-11-(2-Pyrazinylcarbonyl)-3-[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.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 1355
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6
Ionization Methods NSI
Analyzers FT
Last Modification 12/18/2020 9:40:11 AM
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Identificators

InChI InChI=1S/C23H19F3N4O3/c24-23(25,26)33-17-3-1-15(2-4-17)18-5-6-20(31)30-12-14-9-16(21(18)30)13-29(11-14)22(32)19-10-27-7-8-28-19/h1-8,10,14,16H,9,11-13H2/t14-,16+/m0/s1
InChI Key PXKJVMVWEXYKBG-GOEBONIOSA-N
Canonical SMILES C1C2CN(CC1C3=C(C=CC(=O)N3C2)C4=CC=C(C=C4)OC(F)(F)F)C(=O)C5=NC=CN=C5
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-(2-pyrazinylcarbonyl)-11-[4-(trifluoromethoxy)phenyl]-, (1R,5S)-;
NAT11-288276

In Other Databases

ChemSpider 5484927
PubChem 7144188