| SpectraBase Spectrum ID |
JPPZzz9YDUm |
| Name |
2,4-Bis(trifluoromethyl)-9H-pyrimido[4,5-b]indole |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H5F6N3 |
| InChI |
InChI=1S/C12H5F6N3/c13-11(14,15)8-7-5-3-1-2-4-6(5)19-9(7)21-10(20-8)12(16,17)18/h1-4H,(H,19,20,21) |
| InChIKey |
KZVFEFMUPBXYFF-UHFFFAOYSA-N |
| Molecular Weight |
305.183 g/mol |
| SMILES |
[nH]1c2c(c3c1nc(nc3C(F)(F)F)C(F)(F)F)cccc2 |
| SPLASH |
splash10-0a4i-0049000000-9b812545c7c57b594c20 |
| Source of Spectrum |
F4-41-3972-14s |
| Wiley ID |
1711811 |
![2,4-Bis(trifluoromethyl)-9H-pyrimido[4,5-b]indole](/api/spectrum/JPPZzz9YDUm/structure.png?h=300&w=458 "2,4-Bis(trifluoromethyl)-9H-pyrimido[4,5-b]indole")
