| SpectraBase Spectrum ID |
1qtPOS7Dpg |
| Name |
(4Z)-1,3,4,5-Tetrahydro-4-(3,3,4,4,4-pentafluoro-2-oxobutylidene)-2H-1,5-benzodiazepin-2-one |
| Alternate Name(s) |
(Z)-4-(3,3,4,4,4-pentafluoro-2-oxobutylidene)-1,3,4,5-tetrahydro-2H-benzo[b][1,4]diazepin-2-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H9F5N2O2 |
| InChI |
InChI=1S/C13H9F5N2O2/c14-12(15,13(16,17)18)10(21)5-7-6-11(22)20-9-4-2-1-3-8(9)19-7/h1-5,19H,6H2,(H,20,22)/b7-5- |
| InChIKey |
KTBAZNVCLNEJSE-ALCCZGGFSA-N |
| Literature Reference DOI |
10.1002/hlca.201500264 |
| Molecular Weight |
320.219 g/mol |
| SMILES |
N1\C(CC(Nc2c1cccc2)=O)=C/C(C(C(F)(F)F)(F)F)=O |
| SPLASH |
splash10-0zmi-1798000000-a9450c109b7fa0eabd64 |
| Source of Spectrum |
H-99-368-3c |
| Wiley ID |
1800084 |
