SpectraBase Spectrum ID |
BQ1HdRCZXkE |
Name |
9-methyl-2-methylthio-6-methoxy-4-trifluoromethyl-9H-pyrimido[4,5-b]indole |
Appearance |
Light yellow crystals |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C14H12F3N3OS |
InChI |
InChI=1S/C14H12F3N3OS/c1-20-9-5-4-7(21-2)6-8(9)10-11(14(15,16)17)18-13(22-3)19-12(10)20/h4-6H,1-3H3 |
InChIKey |
MRJCPOJABIBDCN-UHFFFAOYSA-N |
Ionization Type |
EI |
Molecular Weight |
327.325 g/mol |
SMILES |
c12[n](c3ccc(cc3c2c(nc(n1)SC)C(F)(F)F)OC)C |
SPLASH |
splash10-004i-0059000000-c91d429c7dd4a68a6b42 |
Source of Spectrum |
RU2625316C1 |
Wiley ID |
1855347 |