Systematic / IUPAC Name: [1-[[(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]piperidin-4-yl]methanol
ID: Reference10623
Other Names: NAT28-412007
Formula: C27H39N3O2
(1-{[(1S,4S,6S)-6-Isopropyl-3-methyl-4-{[5-(4-methylphenyl)-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.
Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
No. of Spectral Trees | 1 |
No. of Spectra | 1345 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 7/2/2021 7:23:30 AM |
InChI | InChI=1S/C27H39N3O2/c1-18(2)25-14-23(15-26-28-29-27(32-26)22-7-5-19(3)6-8-22)20(4)13-24(25)16-30-11-9-21(17-31)10-12-30/h5-8,13,18,21,23-25,31H,9-12,14-17H2,1-4H3/t23-,24-,25-/m0/s1 |
InChI Key | DGPCOTSOFDJRDZ-SDHOMARFSA-N |
Canonical SMILES | CC1=CC=C(C=C1)C2=NN=C(O2)CC3CC(C(C=C3C)CN4CCC(CC4)CO)C(C)C |
CAS | |
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Other Names | NAT28-412007 |