4-{[(1S,4S,6S)-6-Isopropyl-3-methyl-4-{[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl}-2-cyclohexen-1-yl]methyl}morpholine
12157
Reference
4-{[(1S,4S,6S)-6-Isopropyl-3-methyl-4-{[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl}-2-cyclohexen-1-yl]methyl}morpholine Structure
Systematic / IUPAC Name: 4-[[(1S,4S,6S)-3-Methyl-4-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl]-6-propan-2-ylcyclohex-2-en-1-yl]methyl]morpholine
ID: Reference12157
Other Names: NAT28-412050
Formula: C25H35N3O2
Spectral Data
4-{[(1S,4S,6S)-6-Isopropyl-3-methyl-4-{[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl}-2-cyclohexen-1-yl]methyl}morpholine 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 | 1385 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 1/20/2023 7:52:44 AM |
Identificators
| InChI | InChI=1S/C25H35N3O2/c1-17(2)23-14-21(19(4)13-22(23)16-28-9-11-29-12-10-28)15-24-26-27-25(30-24)20-7-5-18(3)6-8-20/h5-8,13,17,21-23H,9-12,14-16H2,1-4H3/t21-,22-,23-/m0/s1 |
| InChI Key | DZPWFOXQGMGBGX-VABKMULXSA-N |
| Canonical SMILES | CC1=CC=C(C=C1)C2=NN=C(O2)CC3CC(C(C=C3C)CN4CCOCC4)C(C)C |
| CAS | |
| Splash | |
| Other Names | NAT28-412050 |