| SpectraBase Spectrum ID |
1CxjOb381ej |
| Name |
6-(3-chloroanilino)-3,3-dimethyl-2,4,7,8,9,10-hexahydrophenanthridin-1-one |
| Alternate Name(s) |
6-[(3-chlorophenyl)amino]-3,3-dimethyl-2,4,7,8,9,10-hexahydrophenanthridin-1-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H23ClN2O |
| InChI |
InChI=1S/C21H23ClN2O/c1-21(2)11-17-19(18(25)12-21)15-8-3-4-9-16(15)20(24-17)23-14-7-5-6-13(22)10-14/h5-7,10H,3-4,8-9,11-12H2,1-2H3,(H,23,24) |
| InChIKey |
VJFQZPOCJUCGFC-UHFFFAOYSA-N |
| Molecular Weight |
354.881 g/mol |
| SMILES |
N(c1nc2CC(C)(C)CC(c2c2c1CCCC2)=O)c1cc(Cl)ccc1 |
| SPLASH |
splash10-0udi-0009000000-0c3e4f08c2e2abe555bc |
| Source of Spectrum |
Y-28-888-6 |
| Wiley ID |
1344696 |
