N-({(1S,4S,6S)-4-[2-(4-Acetyl-1-piperazinyl)-2-oxoethyl]-6-isopropyl-3-methyl-2-cyclohexen-1-yl}methyl)-2-methoxyacetamide
13129
Reference
N-({(1S,4S,6S)-4-[2-(4-Acetyl-1-piperazinyl)-2-oxoethyl]-6-isopropyl-3-methyl-2-cyclohexen-1-yl}methyl)-2-methoxyacetamide 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]-2-methoxyacetamide
ID: Reference13129
Other Names: NAT28-402092
Formula: C22H37N3O4
Spectral Data
N-({(1S,4S,6S)-4-[2-(4-Acetyl-1-piperazinyl)-2-oxoethyl]-6-isopropyl-3-methyl-2-cyclohexen-1-yl}methyl)-2-methoxyacetamide 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 | 2625 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 5/3/2024 12:04:45 PM |
Identificators
| InChI | InChI=1S/C22H37N3O4/c1-15(2)20-11-18(16(3)10-19(20)13-23-21(27)14-29-5)12-22(28)25-8-6-24(7-9-25)17(4)26/h10,15,18-20H,6-9,11-14H2,1-5H3,(H,23,27)/t18-,19-,20-/m0/s1 |
| InChI Key | JPGTXXXTHTYHBE-UFYCRDLUSA-N |
| Canonical SMILES | CC1=CC(C(CC1CC(=O)N2CCN(CC2)C(=O)C)C(C)C)CNC(=O)COC |
| CAS | |
| Splash | |
| Other Names | NAT28-402092 |