| SpectraBase Spectrum ID |
ALt5BBSQztA |
| Name |
(Z/E)-Ethyl-2-methyl-3-(5-(2,2,2-trifluoroacetyl)-5H-dibenzo[b,e]azepin-11(6H)-ylidene)propanoate |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H20F3NO3 |
| InChI |
InChI=1S/C22H20F3NO3/c1-3-29-20(27)14(2)12-18-16-9-5-4-8-15(16)13-26(21(28)22(23,24)25)19-11-7-6-10-17(18)19/h4-12,14H,3,13H2,1-2H3 |
| InChIKey |
YTISOQDVQYRXON-UHFFFAOYSA-N |
| Instrument Name |
LRMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/adsc.201900776 |
| Molecular Weight |
403.401 g/mol |
| Reported Formula |
C22H20F3NO3 |
| SMILES |
C(OCC)(=O)C(C)C=C1c2ccccc2CN(C(C(F)(F)F)=O)c2ccccc12 |
| SPLASH |
splash10-0006-9002000000-722c97e56702de7c80a9 |
| Sample Comments |
Z/E = 7:3 |
| Source of Spectrum |
ASC-361-SM7-3ab |
| Wiley ID |
1838019 |
![(Z/E)-Ethyl-2-methyl-3-(5-(2,2,2-trifluoroacetyl)-5H-dibenzo[b,e]azepin-11(6H)-ylidene)propanoate](/api/spectrum/ALt5BBSQztA/structure.png?h=300&w=458 "(Z/E)-Ethyl-2-methyl-3-(5-(2,2,2-trifluoroacetyl)-5H-dibenzo[b,e]azepin-11(6H)-ylidene)propanoate")
