(1R,9S)-11-(Tetrahydro-2H-pyran-4-yl)-5-[4-(trifluoromethoxy)phenyl]-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one

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Systematic / IUPAC Name: (1R,9S)-11-(Oxan-4-yl)-5-[4-(trifluoromethoxy)phenyl]-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one

ID: Reference10056

Other Names: 1,5-Methano-8H-pyrido[1,2-a][1,5]diazocin-8-one, 1,2,3,4,5,6-hexahydro-3-(tetrahydro-2H-pyran-4-yl)-9-[4-(trifluoromethoxy)phenyl]-, (1R,5S)-;
NAT11-286858

Formula: C23H25F3N2O3

Spectral Data

(1R,9S)-11-(Tetrahydro-2H-pyran-4-yl)-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.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 1053
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6
Ionization Methods NSI
Analyzers FT
Last Modification 11/13/2020 11:24:33 AM
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Identificators

InChI InChI=1S/C23H25F3N2O3/c24-23(25,26)31-19-3-1-16(2-4-19)20-5-6-21-17-11-15(13-28(21)22(20)29)12-27(14-17)18-7-9-30-10-8-18/h1-6,15,17-18H,7-14H2/t15-,17+/m0/s1
InChI Key OWWAALGBBYXXSL-DOTOQJQBSA-N
Canonical SMILES C1COCCC1N2CC3CC(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-(tetrahydro-2H-pyran-4-yl)-9-[4-(trifluoromethoxy)phenyl]-, (1R,5S)-;
NAT11-286858

In Other Databases

ChemSpider 10086761
PubChem 11912438