SpectraBase Spectrum ID |
5GTKT4qS0m6 |
Name |
N(1)-[N-(pentafluoroethyl)carbonyl-N-methylamino-1',1',2',3',3'-pentadeuteriopropyl]-10,11-dihydro-3-chlorodibenz[b,f]azepine |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H15D5ClF5N2O |
InChI |
InChI=1S/C21H20ClF5N2O/c1-28(19(30)20(23,24)21(25,26)27)11-4-12-29-17-6-3-2-5-14(17)7-8-15-9-10-16(22)13-18(15)29/h2-3,5-6,9-10,13H,4,7-8,11-12H2,1H3/i4D,11D2,12D2 |
InChIKey |
HARFHDBUYIKGHZ-FZIGFKTKSA-N |
Molecular Weight |
451.880 g/mol |
SMILES |
C(C(N(C(C(C(N1c2cc(Cl)ccc2CCc2c1cccc2)([2D])[2D])[2D])([2D])[2D])C)=O)(C(F)(F)F)(F)F |
SPLASH |
splash10-0006-0290000000-595a441801e21209bba8 |
Source of Spectrum |
JC-428-75-3 |
Wiley ID |
1386503 |