(1R,9S)-11-Isonicotinoyl-5-(4-methoxyphenyl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one
13185
Reference
(1R,9S)-11-Isonicotinoyl-5-(4-methoxyphenyl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one Structure
Systematic / IUPAC Name: (1R,9S)-5-(4-Methoxyphenyl)-11-(pyridine-4-carbonyl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one
ID: Reference13185
Other Names: NAT11-283696
Formula: C24H23N3O3
Spectral Data
(1R,9S)-11-Isonicotinoyl-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 | 775 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 6/14/2024 1:51:07 PM |
Identificators
| InChI | InChI=1S/C24H23N3O3/c1-30-20-4-2-17(3-5-20)21-6-7-22-19-12-16(14-27(22)24(21)29)13-26(15-19)23(28)18-8-10-25-11-9-18/h2-11,16,19H,12-15H2,1H3/t16-,19+/m0/s1 |
| InChI Key | NQOJXCFDHWWFHK-QFBILLFUSA-N |
| Canonical SMILES | COC1=CC=C(C=C1)C2=CC=C3C4CC(CN(C4)C(=O)C5=CC=NC=C5)CN3C2=O |
| CAS | |
| Splash | |
| Other Names | NAT11-283696 |