Systematic / IUPAC Name: [1-[[(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]piperidin-4-yl]methanol
ID: Reference10918
Other Names:
4-Piperidinemethanol, 1-[[(1S,4S,6S)-4-[[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]-3-methyl-6-(1-methylethyl)-2-cyclohexen-1-yl]methyl]-;
NAT28-414471
Formula: C26H36FN3O2
(1-{[(1S,4S,6S)-4-{[5-(2-Fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl}-6-isopropyl-3-methyl-2-cyclohexen-1-yl]methyl}-4-piperidinyl)methanol 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 | 1756 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 10/4/2021 12:53:08 PM |
InChI | InChI=1S/C26H36FN3O2/c1-17(2)23-13-20(14-25-28-29-26(32-25)22-6-4-5-7-24(22)27)18(3)12-21(23)15-30-10-8-19(16-31)9-11-30/h4-7,12,17,19-21,23,31H,8-11,13-16H2,1-3H3/t20-,21-,23-/m0/s1 |
InChI Key | FZZBBOAXORXYKG-FUDKSRODSA-N |
Canonical SMILES | CC1=CC(C(CC1CC2=NN=C(O2)C3=CC=CC=C3F)C(C)C)CN4CCC(CC4)CO |
CAS | |
Splash | |
Other Names |
4-Piperidinemethanol, 1-[[(1S,4S,6S)-4-[[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]-3-methyl-6-(1-methylethyl)-2-cyclohexen-1-yl]methyl]-; NAT28-414471 |