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

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Systematic / IUPAC Name: (1R,9S)-11-(4-Fluorobenzoyl)-3-pyridin-3-yl-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one

ID: Reference9575

Other Names: 1,5-Methano-8H-pyrido[1,2-a][1,5]diazocin-8-one, 3-(4-fluorobenzoyl)-1,2,3,4,5,6-hexahydro-11-(3-pyridinyl)-, (1R,5S)-;
NAT11-288564

Formula: C23H20FN3O2

Spectral Data

(1R,9S)-11-(4-Fluorobenzoyl)-3-(3-pyridinyl)-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 548
Tandem Spectra MS1, MS2, MS3
Ionization Methods NSI
Analyzers FT
Last Modification 4/15/2020 6:28:44 AM
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Identificators

InChI InChI=1S/C23H20FN3O2/c24-19-5-3-16(4-6-19)23(29)26-12-15-10-18(14-26)22-20(17-2-1-9-25-11-17)7-8-21(28)27(22)13-15/h1-9,11,15,18H,10,12-14H2/t15-,18+/m0/s1
InChI Key KFAMDIJAXHGOBU-MAUKXSAKSA-N
Canonical SMILES C1C2CN(CC1C3=C(C=CC(=O)N3C2)C4=CN=CC=C4)C(=O)C5=CC=C(C=C5)F
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Other Names 1,5-Methano-8H-pyrido[1,2-a][1,5]diazocin-8-one, 3-(4-fluorobenzoyl)-1,2,3,4,5,6-hexahydro-11-(3-pyridinyl)-, (1R,5S)-;
NAT11-288564

In Other Databases

ChemSpider 5409913
PubChem 7051762