2-[(1S,4S,5S)-4-{[(Cyclohexylcarbamoyl)amino]methyl}-5-isopropyl-2-methyl-2-cyclohexen-1-yl]-N-[2-(dimethylamino)ethyl]acetamide
10308
Reference
2-[(1S,4S,5S)-4-{[(Cyclohexylcarbamoyl)amino]methyl}-5-isopropyl-2-methyl-2-cyclohexen-1-yl]-N-[2-(dimethylamino)ethyl]acetamide Structure
Systematic / IUPAC Name: 2-[(1S,4S,5S)-4-[(Cyclohexylcarbamoylamino)methyl]-2-methyl-5-propan-2-ylcyclohex-2-en-1-yl]-N-[2-(dimethylamino)ethyl]acetamide
ID: Reference10308
Other Names: NAT28-403665
Formula: C24H44N4O2
Spectral Data
2-[(1S,4S,5S)-4-{[(Cyclohexylcarbamoyl)amino]methyl}-5-isopropyl-2-methyl-2-cyclohexen-1-yl]-N-[2-(dimethylamino)ethyl]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 | 2 |
| No. of Spectra | 3287 |
| Tandem Spectra | MS1, MS2, MS3, MS4, MS5 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 3/19/2021 12:26:06 PM |
Identificators
| InChI | InChI=1S/C24H44N4O2/c1-17(2)22-14-19(15-23(29)25-11-12-28(4)5)18(3)13-20(22)16-26-24(30)27-21-9-7-6-8-10-21/h13,17,19-22H,6-12,14-16H2,1-5H3,(H,25,29)(H2,26,27,30)/t19-,20-,22-/m0/s1 |
| InChI Key | UQVYFJVJUWEYSR-ONTIZHBOSA-N |
| Canonical SMILES | CC1=CC(C(CC1CC(=O)NCCN(C)C)C(C)C)CNC(=O)NC2CCCCC2 |
| CAS | |
| Splash | |
| Other Names | NAT28-403665 |