N-({(1S,4S,6S)-4-[2-(4-Acetyl-1-piperazinyl)-2-oxoethyl]-6-isopropyl-3-methyl-2-cyclohexen-1-yl}methyl)acetamide
13127
Reference
N-({(1S,4S,6S)-4-[2-(4-Acetyl-1-piperazinyl)-2-oxoethyl]-6-isopropyl-3-methyl-2-cyclohexen-1-yl}methyl)acetamide Structure
Systematic / IUPAC Name: N-[[(1S,4S,6S)-4-[2-(4-Acetylpiperazin-1-yl)-2-oxoethyl]-3-methyl-6-propan-2-ylcyclohex-2-en-1-yl]methyl]acetamide
ID: Reference13127
Other Names: NAT28-402077
Formula: C21H35N3O3
Spectral Data
N-({(1S,4S,6S)-4-[2-(4-Acetyl-1-piperazinyl)-2-oxoethyl]-6-isopropyl-3-methyl-2-cyclohexen-1-yl}methyl)acetamide 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 | 2623 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 5/3/2024 12:03:29 PM |
Identificators
| InChI | InChI=1S/C21H35N3O3/c1-14(2)20-11-18(15(3)10-19(20)13-22-16(4)25)12-21(27)24-8-6-23(7-9-24)17(5)26/h10,14,18-20H,6-9,11-13H2,1-5H3,(H,22,25)/t18-,19-,20-/m0/s1 |
| InChI Key | NGLMAJKPVWKBCC-UFYCRDLUSA-N |
| Canonical SMILES | CC1=CC(C(CC1CC(=O)N2CCN(CC2)C(=O)C)C(C)C)CNC(=O)C |
| CAS | |
| Splash | |
| Other Names | NAT28-402077 |