Systematic / IUPAC Name: N-[[(1S,4S,6S)-4-[[5-(2-Fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]-3-methyl-6-propan-2-ylcyclohex-2-en-1-yl]methyl]-2,2-dimethylpropanamide
ID: Reference10555
Other Names:
Propanamide, N-[[(1S,4S,6S)-4-[[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]-3-methyl-6-(1-methylethyl)-2-cyclohexen-1-yl]methyl]-2,2-dimethyl-;
NAT28-417637
Formula: C25H34FN3O2
N-{[(1S,4S,6S)-4-{[5-(2-Fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl}-6-isopropyl-3-methyl-2-cyclohexen-1-yl]methyl}-2,2-dimethylpropanamide 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 | 2 |
No. of Spectra | 2989 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 6/18/2021 6:52:57 AM |
InChI | InChI=1S/C25H34FN3O2/c1-15(2)20-12-17(16(3)11-18(20)14-27-24(30)25(4,5)6)13-22-28-29-23(31-22)19-9-7-8-10-21(19)26/h7-11,15,17-18,20H,12-14H2,1-6H3,(H,27,30)/t17-,18-,20-/m0/s1 |
InChI Key | PPDWTLYWYQXQKT-BJLQDIEVSA-N |
Canonical SMILES | CC1=CC(C(CC1CC2=NN=C(O2)C3=CC=CC=C3F)C(C)C)CNC(=O)C(C)(C)C |
CAS | |
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Other Names |
Propanamide, N-[[(1S,4S,6S)-4-[[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]-3-methyl-6-(1-methylethyl)-2-cyclohexen-1-yl]methyl]-2,2-dimethyl-; NAT28-417637 |