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

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

ID: Reference12938

Other Names: NAT11-288257

Formula: C23H19F3N2O3S

Spectral Data

(1R,9S)-11-(2-Thienylcarbonyl)-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 975
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 12/14/2023 12:47:58 PM
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Identificators

InChI InChI=1S/C23H19F3N2O3S/c24-23(25,26)31-17-5-3-15(4-6-17)18-7-8-20(29)28-12-14-10-16(21(18)28)13-27(11-14)22(30)19-2-1-9-32-19/h1-9,14,16H,10-13H2/t14-,16+/m0/s1
InChI Key ZKPCAMUSXKAJTR-GOEBONIOSA-N
Canonical SMILES C1C2CN(CC1C3=C(C=CC(=O)N3C2)C4=CC=C(C=C4)OC(F)(F)F)C(=O)C5=CC=CS5
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Other Names NAT11-288257

In Other Databases

ChemSpider 5484917
PubChem 7144178