(1-{[(1S,4S,6S)-6-Isopropyl-3-methyl-4-{[5-(2-methyl-2-propanyl)-1,3,4-oxadiazol-2-yl]methyl}-2-cyclohexen-1-yl]methyl}-4-piperidinyl)methanol
13136
Reference
(1-{[(1S,4S,6S)-6-Isopropyl-3-methyl-4-{[5-(2-methyl-2-propanyl)-1,3,4-oxadiazol-2-yl]methyl}-2-cyclohexen-1-yl]methyl}-4-piperidinyl)methanol Structure
Systematic / IUPAC Name: [1-[[(1S,4S,6S)-4-[(5-tert-Butyl-1,3,4-oxadiazol-2-yl)methyl]-3-methyl-6-propan-2-ylcyclohex-2-en-1-yl]methyl]piperidin-4-yl]methanol
ID: Reference13136
Other Names: NAT28-414583
Formula: C24H41N3O2
Spectral Data
(1-{[(1S,4S,6S)-6-Isopropyl-3-methyl-4-{[5-(2-methyl-2-propanyl)-1,3,4-oxadiazol-2-yl]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.
Available MS Data
| Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
| No. of Spectral Trees | 1 |
| No. of Spectra | 775 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 5/9/2024 10:49:09 AM |
Identificators
| InChI | InChI=1S/C24H41N3O2/c1-16(2)21-12-19(13-22-25-26-23(29-22)24(4,5)6)17(3)11-20(21)14-27-9-7-18(15-28)8-10-27/h11,16,18-21,28H,7-10,12-15H2,1-6H3/t19-,20-,21-/m0/s1 |
| InChI Key | ZQKYHLKIMCNCAL-ACRUOGEOSA-N |
| Canonical SMILES | CC1=CC(C(CC1CC2=NN=C(O2)C(C)(C)C)C(C)C)CN3CCC(CC3)CO |
| CAS | |
| Splash | |
| Other Names | NAT28-414583 |