SpectraBase Spectrum ID |
Kpvn8wggpvB |
Name |
8-Chloro-5-oxo-10,11-dihydro-5H-dibenzo[a,d]cycloheptene-3-carboxylic acid (2-morpholin-4-yl-ethyl)-amide |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C22H23ClN2O3 |
InChI |
InChI=1S/C22H23ClN2O3/c23-18-5-6-19-16(13-18)3-1-15-2-4-17(14-20(15)21(19)26)22(27)24-7-8-25-9-11-28-12-10-25/h2,4-6,13-14H,1,3,7-12H2,(H,24,27) |
InChIKey |
BARSEVATJIGQFI-UHFFFAOYSA-N |
Instrument Name |
HP 6890-5973 |
Ionization Type |
EI |
Literature Reference DOI |
10.1021/jm301539x |
Molecular Weight |
398.890 g/mol |
SMILES |
N(C(c1cc2c(CCc3c(C2=O)ccc(c3)Cl)cc1)=O)CCN1CCOCC1 |
SPLASH |
splash10-0udi-0900000000-97f8c4fcd7641bbc7430 |
Source of Spectrum |
AF-56-SM18-10b |
Wiley ID |
1854396 |