1-(3,4-Dihydro-2(1H)-isoquinolinyl)-2-[(3R,4S)-3-({5-[4-(2-methyl-2-propanyl)phenyl]-1,2-oxazol-3-yl}methyl)-4-piperidinyl]ethanone
12914
Reference
1-(3,4-Dihydro-2(1H)-isoquinolinyl)-2-[(3R,4S)-3-({5-[4-(2-methyl-2-propanyl)phenyl]-1,2-oxazol-3-yl}methyl)-4-piperidinyl]ethanone Structure
Systematic / IUPAC Name: 2-[(3R,4S)-3-[[5-(4-tert-Butylphenyl)-1,2-oxazol-3-yl]methyl]piperidin-4-yl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone
ID: Reference12914
Other Names: NAT14-350422
Formula: C30H37N3O2
Spectral Data
1-(3,4-Dihydro-2(1H)-isoquinolinyl)-2-[(3R,4S)-3-({5-[4-(2-methyl-2-propanyl)phenyl]-1,2-oxazol-3-yl}methyl)-4-piperidinyl]ethanone 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 | 1020 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 12/1/2023 10:09:04 AM |
Identificators
| InChI | InChI=1S/C30H37N3O2/c1-30(2,3)26-10-8-22(9-11-26)28-18-27(32-35-28)16-25-19-31-14-12-23(25)17-29(34)33-15-13-21-6-4-5-7-24(21)20-33/h4-11,18,23,25,31H,12-17,19-20H2,1-3H3/t23-,25-/m0/s1 |
| InChI Key | JOWPDXAKRRWNHI-ZCYQVOJMSA-N |
| Canonical SMILES | CC(C)(C)C1=CC=C(C=C1)C2=CC(=NO2)CC3CNCCC3CC(=O)N4CCC5=CC=CC=C5C4 |
| CAS | |
| Splash | |
| Other Names | NAT14-350422 |