[(1S,4S,6S)-6-Isopropyl-3-methyl-4-{[5-(1-methyl-1H-imidazol-5-yl)-1,3,4-oxadiazol-2-yl]methyl}-2-cyclohexen-1-yl]methanol
12211
Reference
[(1S,4S,6S)-6-Isopropyl-3-methyl-4-{[5-(1-methyl-1H-imidazol-5-yl)-1,3,4-oxadiazol-2-yl]methyl}-2-cyclohexen-1-yl]methanol Structure
Systematic / IUPAC Name: [(1S,4S,6S)-3-Methyl-4-[[5-(3-methylimidazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl]-6-propan-2-ylcyclohex-2-en-1-yl]methanol
ID: Reference12211
Other Names: NAT28-416278
Formula: C18H26N4O2
Spectral Data
[(1S,4S,6S)-6-Isopropyl-3-methyl-4-{[5-(1-methyl-1H-imidazol-5-yl)-1,3,4-oxadiazol-2-yl]methyl}-2-cyclohexen-1-yl]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 | 1710 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 2/3/2023 9:00:41 AM |
Identificators
| InChI | InChI=1S/C18H26N4O2/c1-11(2)15-6-13(12(3)5-14(15)9-23)7-17-20-21-18(24-17)16-8-19-10-22(16)4/h5,8,10-11,13-15,23H,6-7,9H2,1-4H3/t13-,14-,15-/m0/s1 |
| InChI Key | FPCVYMWSFDLDNO-KKUMJFAQSA-N |
| Canonical SMILES | CC1=CC(C(CC1CC2=NN=C(O2)C3=CN=CN3C)C(C)C)CO |
| CAS | |
| Splash | |
| Other Names | NAT28-416278 |