(1R,9R)-11-[(4-Fluorophenyl)sulfonyl]-5-(4-methoxyphenyl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one
13175
Reference
(1R,9R)-11-[(4-Fluorophenyl)sulfonyl]-5-(4-methoxyphenyl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one Structure
Systematic / IUPAC Name: (1R,9R)-11-(4-Fluorophenyl)sulfonyl-5-(4-methoxyphenyl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one
ID: Reference13175
Other Names: NAT11-283735
Formula: C24H23FN2O4S
Spectral Data
(1R,9R)-11-[(4-Fluorophenyl)sulfonyl]-5-(4-methoxyphenyl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one 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 | 2535 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 6/6/2024 10:22:53 AM |
Identificators
| InChI | InChI=1S/C24H23FN2O4S/c1-31-20-6-2-17(3-7-20)22-10-11-23-18-12-16(14-27(23)24(22)28)13-26(15-18)32(29,30)21-8-4-19(25)5-9-21/h2-11,16,18H,12-15H2,1H3/t16-,18+/m0/s1 |
| InChI Key | AIWLZNQEOGNMSQ-FUHWJXTLSA-N |
| Canonical SMILES | COC1=CC=C(C=C1)C2=CC=C3C4CC(CN(C4)S(=O)(=O)C5=CC=C(C=C5)F)CN3C2=O |
| CAS | |
| Splash | |
| Other Names | NAT11-283735 |