[(2S)-1-({(1S,4S,6S)-6-Isopropyl-3-methyl-4-[(5-propyl-1,3,4-oxadiazol-2-yl)methyl]-2-cyclohexen-1-yl}methyl)-2-pyrrolidinyl]methanol
10627
Reference
[(2S)-1-({(1S,4S,6S)-6-Isopropyl-3-methyl-4-[(5-propyl-1,3,4-oxadiazol-2-yl)methyl]-2-cyclohexen-1-yl}methyl)-2-pyrrolidinyl]methanol Structure
Systematic / IUPAC Name: [(2S)-1-[[(1S,4S,6S)-3-Methyl-6-propan-2-yl-4-[(5-propyl-1,3,4-oxadiazol-2-yl)methyl]cyclohex-2-en-1-yl]methyl]pyrrolidin-2-yl]methanol
ID: Reference10627
Other Names: NAT28-413068
Formula: C22H37N3O2
Spectral Data
[(2S)-1-({(1S,4S,6S)-6-Isopropyl-3-methyl-4-[(5-propyl-1,3,4-oxadiazol-2-yl)methyl]-2-cyclohexen-1-yl}methyl)-2-pyrrolidinyl]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 | 1080 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 7/2/2021 7:28:01 AM |
Identificators
| InChI | InChI=1S/C22H37N3O2/c1-5-7-21-23-24-22(27-21)12-17-11-20(15(2)3)18(10-16(17)4)13-25-9-6-8-19(25)14-26/h10,15,17-20,26H,5-9,11-14H2,1-4H3/t17-,18-,19-,20-/m0/s1 |
| InChI Key | WHKCGHGWZXKWPZ-MUGJNUQGSA-N |
| Canonical SMILES | CCCC1=NN=C(O1)CC2CC(C(C=C2C)CN3CCCC3CO)C(C)C |
| CAS | |
| Splash | |
| Other Names | NAT28-413068 |