2-({(6S)-6-[3-(3-Methylphenyl)-1,2,4-oxadiazol-5-yl]-1,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-yl}carbonyl)benzoic acid
12206
Reference
2-({(6S)-6-[3-(3-Methylphenyl)-1,2,4-oxadiazol-5-yl]-1,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-yl}carbonyl)benzoic acid Structure
Systematic / IUPAC Name: 2-[(6S)-6-[3-(3-Methylphenyl)-1,2,4-oxadiazol-5-yl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carbonyl]benzoic acid
ID: Reference12206
Other Names: NAT22-366447
Formula: C23H19N5O4
Spectral Data
2-({(6S)-6-[3-(3-Methylphenyl)-1,2,4-oxadiazol-5-yl]-1,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-yl}carbonyl)benzoic acid mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
| No. of Spectral Trees | 1 |
| No. of Spectra | 2207 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 2/1/2023 4:39:10 PM |
Identificators
| InChI | InChI=1S/C23H19N5O4/c1-13-5-4-6-14(9-13)20-26-21(32-27-20)19-10-17-18(25-12-24-17)11-28(19)22(29)15-7-2-3-8-16(15)23(30)31/h2-9,12,19H,10-11H2,1H3,(H,24,25)(H,30,31)/t19-/m0/s1 |
| InChI Key | WNDACUANOKRYJD-IBGZPJMESA-N |
| Canonical SMILES | CC1=CC(=CC=C1)C2=NOC(=N2)C3CC4=C(CN3C(=O)C5=CC=CC=C5C(=O)O)NC=N4 |
| CAS | |
| Splash | |
| Other Names | NAT22-366447 |