Systematic / IUPAC Name: 5-[(6S)-5-Benzyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-6-yl]-3-(3-chloro-4-fluorophenyl)-1,2,4-oxadiazole
ID: Reference12081
Other Names: NAT22-381465
Formula: C21H17ClFN5O
(6S)-5-Benzyl-6-[3-(3-chloro-4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
No. of Spectral Trees | 1 |
No. of Spectra | 585 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 12/21/2022 7:55:30 AM |
InChI | InChI=1S/C21H17ClFN5O/c22-15-8-14(6-7-16(15)23)20-26-21(29-27-20)19-9-17-18(25-12-24-17)11-28(19)10-13-4-2-1-3-5-13/h1-8,12,19H,9-11H2,(H,24,25)/t19-/m0/s1 |
InChI Key | KCPIFPKMLIMJLK-IBGZPJMESA-N |
Canonical SMILES | C1C(N(CC2=C1N=CN2)CC3=CC=CC=C3)C4=NC(=NO4)C5=CC(=C(C=C5)F)Cl |
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Other Names | NAT22-381465 |