4-Fluoro-N-[(1R,9S)-11-(4-fluorobenzoyl)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-5-yl]benzamide

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Systematic / IUPAC Name: 4-Fluoro-N-[(1R,9S)-11-(4-fluorobenzoyl)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-5-yl]benzamide

ID: Reference10979

Other Names: NAT11-291893

Formula: C25H21F2N3O3

Spectral Data

4-Fluoro-N-[(1R,9S)-11-(4-fluorobenzoyl)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-5-yl]benzamide 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 1131
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 10/28/2021 5:48:46 PM
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Identificators

InChI InChI=1S/C25H21F2N3O3/c26-19-5-1-16(2-6-19)23(31)28-21-9-10-22-18-11-15(13-30(22)25(21)33)12-29(14-18)24(32)17-3-7-20(27)8-4-17/h1-10,15,18H,11-14H2,(H,28,31)/t15-,18+/m0/s1
InChI Key YGMUPMPKABJSJK-MAUKXSAKSA-N
Canonical SMILES C1C2CN(CC1C3=CC=C(C(=O)N3C2)NC(=O)C4=CC=C(C=C4)F)C(=O)C5=CC=C(C=C5)F
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Other Names NAT11-291893

In Other Databases

ChemSpider 10060201
PubChem 11885878