(1R,9S)-11-(4-Methoxybenzoyl)-5-(3-pyridinyl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one
13139
Reference
(1R,9S)-11-(4-Methoxybenzoyl)-5-(3-pyridinyl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one Structure
Systematic / IUPAC Name: (1R,9S)-11-(4-Methoxybenzoyl)-5-pyridin-3-yl-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one
ID: Reference13139
Other Names: NAT11-284878
Formula: C24H23N3O3
Spectral Data
(1R,9S)-11-(4-Methoxybenzoyl)-5-(3-pyridinyl)-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 | 579 |
| Tandem Spectra | MS1, MS2, MS3 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 5/13/2024 8:08:25 AM |
Identificators
| InChI | InChI=1S/C24H23N3O3/c1-30-20-6-4-17(5-7-20)23(28)26-13-16-11-19(15-26)22-9-8-21(24(29)27(22)14-16)18-3-2-10-25-12-18/h2-10,12,16,19H,11,13-15H2,1H3/t16-,19+/m0/s1 |
| InChI Key | PLUROLYYGZXUDD-QFBILLFUSA-N |
| Canonical SMILES | COC1=CC=C(C=C1)C(=O)N2CC3CC(C2)C4=CC=C(C(=O)N4C3)C5=CN=CC=C5 |
| CAS | |
| Splash | |
| Other Names | NAT11-284878 |