4-Oxo-4-[(6S)-6-{3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl}-1,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-yl]butanoic acid

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Systematic / IUPAC Name: 4-Oxo-4-[(6S)-6-[3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]butanoic acid

ID: Reference12085

Other Names: NAT22-366257

Formula: C19H16F3N5O5

Spectral Data

4-Oxo-4-[(6S)-6-{3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl}-1,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-yl]butanoic 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 2097
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 1/2/2023 3:06:56 PM
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Identificators

InChI InChI=1S/C19H16F3N5O5/c20-19(21,22)31-11-3-1-10(2-4-11)17-25-18(32-26-17)14-7-12-13(24-9-23-12)8-27(14)15(28)5-6-16(29)30/h1-4,9,14H,5-8H2,(H,23,24)(H,29,30)/t14-/m0/s1
InChI Key SZSXPNVGJYCTPK-AWEZNQCLSA-N
Canonical SMILES C1C(N(CC2=C1N=CN2)C(=O)CCC(=O)O)C3=NC(=NO3)C4=CC=C(C=C4)OC(F)(F)F
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Other Names NAT22-366257

In Other Databases

PubChem 45783844
ChemSpider 29859164