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

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

ID: Reference8865

Other Names: (1R,9R)-3-(2-Fluorophenyl)-11-(phenylsulfonyl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one;
NAT11-287939

Formula: C23H21FN2O3S

Spectral Data

(1R,9R)-3-(2-Fluorophenyl)-11-(phenylsulfonyl)-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 FAIMS
No. of Spectral Trees 1
No. of Spectra 2284
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods NSI
Analyzers FT
Last Modification 9/2/2019 7:10:34 AM
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Identificators

InChI InChI=1S/C23H21FN2O3S/c24-21-9-5-4-8-19(21)20-10-11-22(27)26-14-16-12-17(23(20)26)15-25(13-16)30(28,29)18-6-2-1-3-7-18/h1-11,16-17H,12-15H2/t16-,17+/m0/s1
InChI Key JTFNPWYWRFRWOK-DLBZAZTESA-N
Canonical SMILES C1C2CN(CC1C3=C(C=CC(=O)N3C2)C4=CC=CC=C4F)S(=O)(=O)C5=CC=CC=C5
CAS
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Other Names (1R,9R)-3-(2-Fluorophenyl)-11-(phenylsulfonyl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one;
NAT11-287939

In Other Databases

ChemSpider 7707774
PubChem 9424526