N-({(1S,4S,6S)-4-[2-(Cyclopentylamino)-2-oxoethyl]-6-isopropyl-3-methyl-2-cyclohexen-1-yl}methyl)benzamide
10478
Reference
N-({(1S,4S,6S)-4-[2-(Cyclopentylamino)-2-oxoethyl]-6-isopropyl-3-methyl-2-cyclohexen-1-yl}methyl)benzamide Structure
Systematic / IUPAC Name: N-[[(1S,4S,6S)-4-[2-(Cyclopentylamino)-2-oxoethyl]-3-methyl-6-propan-2-ylcyclohex-2-en-1-yl]methyl]benzamide
ID: Reference10478
Other Names: NAT28-403269
Formula: C25H36N2O2
Spectral Data
N-({(1S,4S,6S)-4-[2-(Cyclopentylamino)-2-oxoethyl]-6-isopropyl-3-methyl-2-cyclohexen-1-yl}methyl)benzamide 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 | 2 |
| No. of Spectra | 3652 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 5/21/2021 12:29:45 PM |
Identificators
| InChI | InChI=1S/C25H36N2O2/c1-17(2)23-14-20(15-24(28)27-22-11-7-8-12-22)18(3)13-21(23)16-26-25(29)19-9-5-4-6-10-19/h4-6,9-10,13,17,20-23H,7-8,11-12,14-16H2,1-3H3,(H,26,29)(H,27,28)/t20-,21-,23-/m0/s1 |
| InChI Key | RGCIEBOMAUQHTG-FUDKSRODSA-N |
| Canonical SMILES | CC1=CC(C(CC1CC(=O)NC2CCCC2)C(C)C)CNC(=O)C3=CC=CC=C3 |
| CAS | |
| Splash | |
| Other Names | NAT28-403269 |