| SpectraBase Spectrum ID |
80WmV2zQqY3 |
| Name |
(2E)-3-cyano-1,1-difluoro-2-[(4-methoxyphenyl)imino]-1H,2H-2l5-[1,3,2]diazaborolo[3,4-a]quinolin-2-ylium-1-uide |
| Appearance |
Purple powder |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H13BF2N4O |
| InChI |
InChI=1S/C18H13BF2N4O/c1-26-15-9-7-14(8-10-15)23-25-18(12-22)17-11-6-13-4-2-3-5-16(13)24(17)19(25,20)21/h2-11H,1H3/b25-23- |
| InChIKey |
FEHBHCWZFXLGBS-BZZOAKBMSA-N |
| Instrument Name |
Shimadzu GCMS-QP2010Plus |
| Ionization Type |
EI |
| Molecular Weight |
350.136 g/mol |
| SMILES |
c1(\N=[N+]\2[B-](F)(F)N3C(=C2C#N)C=Cc2c3cccc2)ccc(cc1)OC |
| SPLASH |
splash10-0pbc-3901000000-fb0fe88ad0e700cdbbf8 |
| Sample Comments |
dr = 97:3 (trans/Cis) |
| Source of Spectrum |
WO2015031518A1 |
| Wiley ID |
1850532 |
![(2E)-3-cyano-1,1-difluoro-2-[(4-methoxyphenyl)imino]-1H,2H-2l5-[1,3,2]diazaborolo[3,4-a]quinolin-2-ylium-1-uide](/api/spectrum/80WmV2zQqY3/structure.png?h=300&w=458 "(2E)-3-cyano-1,1-difluoro-2-[(4-methoxyphenyl)imino]-1H,2H-2l5-[1,3,2]diazaborolo[3,4-a]quinolin-2-ylium-1-uide")
