(1R,9S)-11-(4-Methoxybenzyl)-3-(2-thienyl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one
11189
Reference
(1R,9S)-11-(4-Methoxybenzyl)-3-(2-thienyl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one Structure
Systematic / IUPAC Name: (1R,9S)-11-[(4-Methoxyphenyl)methyl]-3-thiophen-2-yl-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one
ID: Reference11189
Other Names: NAT11-289626
Formula: C23H24N2O2S
Spectral Data
(1R,9S)-11-(4-Methoxybenzyl)-3-(2-thienyl)-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 | 310 |
| Tandem Spectra | MS1, MS2, MS3 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 2/4/2022 10:11:54 AM |
Identificators
| InChI | InChI=1S/C23H24N2O2S/c1-27-19-6-4-16(5-7-19)12-24-13-17-11-18(15-24)23-20(21-3-2-10-28-21)8-9-22(26)25(23)14-17/h2-10,17-18H,11-15H2,1H3/t17-,18+/m0/s1 |
| InChI Key | GLVKJIKFFXVOJU-ZWKOTPCHSA-N |
| Canonical SMILES | COC1=CC=C(C=C1)CN2CC3CC(C2)C4=C(C=CC(=O)N4C3)C5=CC=CS5 |
| CAS | |
| Splash | |
| Other Names | NAT11-289626 |