4-({(6S)-6-[3-(3-Chloro-4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-1,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-yl}methyl)benzoic acid

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Systematic / IUPAC Name: 4-[[(6S)-6-[3-(3-Chloro-4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methyl]benzoic acid

ID: Reference12082

Other Names: NAT22-381466

Formula: C22H17ClFN5O3

Spectral Data

4-({(6S)-6-[3-(3-Chloro-4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-1,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-yl}methyl)benzoic acid 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 755
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 12/21/2022 7:56:23 AM
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Identificators

InChI InChI=1S/C22H17ClFN5O3/c23-15-7-14(5-6-16(15)24)20-27-21(32-28-20)19-8-17-18(26-11-25-17)10-29(19)9-12-1-3-13(4-2-12)22(30)31/h1-7,11,19H,8-10H2,(H,25,26)(H,30,31)/t19-/m0/s1
InChI Key MXCISPKJCZPIMV-IBGZPJMESA-N
Canonical SMILES C1C(N(CC2=C1N=CN2)CC3=CC=C(C=C3)C(=O)O)C4=NC(=NO4)C5=CC(=C(C=C5)F)Cl
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Other Names NAT22-381466

In Other Databases

ChemSpider 21382342
PubChem 26761934