2-[(1S,4S,5S)-4-{[(Ethylcarbamoyl)amino]methyl}-5-isopropyl-2-methyl-2-cyclohexen-1-yl]-N-(4-fluorobenzyl)acetamide
10307
Reference
2-[(1S,4S,5S)-4-{[(Ethylcarbamoyl)amino]methyl}-5-isopropyl-2-methyl-2-cyclohexen-1-yl]-N-(4-fluorobenzyl)acetamide Structure
Systematic / IUPAC Name: 2-[(1S,4S,5S)-4-[(Ethylcarbamoylamino)methyl]-2-methyl-5-propan-2-ylcyclohex-2-en-1-yl]-N-[(4-fluorophenyl)methyl]acetamide
ID: Reference10307
Other Names: NAT28-403746
Formula: C23H34FN3O2
Spectral Data
2-[(1S,4S,5S)-4-{[(Ethylcarbamoyl)amino]methyl}-5-isopropyl-2-methyl-2-cyclohexen-1-yl]-N-(4-fluorobenzyl)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 | 961 |
| Tandem Spectra | MS1, MS2, MS3, MS4, MS5 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 3/19/2021 11:43:02 AM |
Identificators
| InChI | InChI=1S/C23H34FN3O2/c1-5-25-23(29)27-14-19-10-16(4)18(11-21(19)15(2)3)12-22(28)26-13-17-6-8-20(24)9-7-17/h6-10,15,18-19,21H,5,11-14H2,1-4H3,(H,26,28)(H2,25,27,29)/t18-,19-,21-/m0/s1 |
| InChI Key | JFXWKCDSKAUCJA-ZJOUEHCJSA-N |
| Canonical SMILES | CCNC(=O)NCC1C=C(C(CC1C(C)C)CC(=O)NCC2=CC=C(C=C2)F)C |
| CAS | |
| Splash | |
| Other Names | NAT28-403746 |