(1R,9R)-5-(4-Methoxyphenyl)-11-(phenylsulfonyl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one
13095
Reference
(1R,9R)-5-(4-Methoxyphenyl)-11-(phenylsulfonyl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one Structure
Systematic / IUPAC Name: (1R,9R)-11-(Benzenesulfonyl)-5-(4-methoxyphenyl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one
ID: Reference13095
Other Names: NAT11-283722
Formula: C24H24N2O4S
Spectral Data
(1R,9R)-5-(4-Methoxyphenyl)-11-(phenylsulfonyl)-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 | 2099 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 4/9/2024 2:21:38 PM |
Identificators
| InChI | InChI=1S/C24H24N2O4S/c1-30-20-9-7-18(8-10-20)22-11-12-23-19-13-17(15-26(23)24(22)27)14-25(16-19)31(28,29)21-5-3-2-4-6-21/h2-12,17,19H,13-16H2,1H3/t17-,19+/m0/s1 |
| InChI Key | BONDZPYKPVTEDS-PKOBYXMFSA-N |
| Canonical SMILES | COC1=CC=C(C=C1)C2=CC=C3C4CC(CN(C4)S(=O)(=O)C5=CC=CC=C5)CN3C2=O |
| CAS | |
| Splash | |
| Other Names | NAT11-283722 |