1-(4-Acetyl-1-piperazinyl)-2-{(3R,4S)-3-[(5-{[benzyl(methyl)amino]methyl}-1,2-oxazol-3-yl)methyl]-4-piperidinyl}ethanone
12078
Reference
1-(4-Acetyl-1-piperazinyl)-2-{(3R,4S)-3-[(5-{[benzyl(methyl)amino]methyl}-1,2-oxazol-3-yl)methyl]-4-piperidinyl}ethanone Structure
Systematic / IUPAC Name: 1-(4-Acetylpiperazin-1-yl)-2-[(3R,4S)-3-[[5-[[benzyl(methyl)amino]methyl]-1,2-oxazol-3-yl]methyl]piperidin-4-yl]ethanone
ID: Reference12078
Other Names: NAT14-350191
Formula: C26H37N5O3
Spectral Data
1-(4-Acetyl-1-piperazinyl)-2-{(3R,4S)-3-[(5-{[benzyl(methyl)amino]methyl}-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 | 1540 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 12/21/2022 7:50:50 AM |
Identificators
| InChI | InChI=1S/C26H37N5O3/c1-20(32)30-10-12-31(13-11-30)26(33)15-22-8-9-27-17-23(22)14-24-16-25(34-28-24)19-29(2)18-21-6-4-3-5-7-21/h3-7,16,22-23,27H,8-15,17-19H2,1-2H3/t22-,23-/m0/s1 |
| InChI Key | ODHHFQDIIAIEGH-GOTSBHOMSA-N |
| Canonical SMILES | CC(=O)N1CCN(CC1)C(=O)CC2CCNCC2CC3=NOC(=C3)CN(C)CC4=CC=CC=C4 |
| CAS | |
| Splash | |
| Other Names | NAT14-350191 |