(1R,9R)-N-(4-Fluorophenyl)-6-oxo-5-[(propylsulfonyl)amino]-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide
13145
Reference
(1R,9R)-N-(4-Fluorophenyl)-6-oxo-5-[(propylsulfonyl)amino]-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide Structure
Systematic / IUPAC Name: (1R,9R)-N-(4-Fluorophenyl)-6-oxo-5-(propylsulfonylamino)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide
ID: Reference13145
Other Names: NAT11-292374
Formula: C21H25FN4O4S
Spectral Data
(1R,9R)-N-(4-Fluorophenyl)-6-oxo-5-[(propylsulfonyl)amino]-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide 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 | 935 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 5/17/2024 5:33:48 PM |
Identificators
| InChI | InChI=1S/C21H25FN4O4S/c1-2-9-31(29,30)24-18-7-8-19-15-10-14(12-26(19)20(18)27)11-25(13-15)21(28)23-17-5-3-16(22)4-6-17/h3-8,14-15,24H,2,9-13H2,1H3,(H,23,28)/t14-,15+/m0/s1 |
| InChI Key | ZBOAZFIFXVZNBE-LSDHHAIUSA-N |
| Canonical SMILES | CCCS(=O)(=O)NC1=CC=C2C3CC(CN(C3)C(=O)NC4=CC=C(C=C4)F)CN2C1=O |
| CAS | |
| Splash | |
| Other Names | NAT11-292374 |