| SpectraBase Spectrum ID |
16KcL0A3WPE |
| Name |
4,4-Difluoro-8-(4-hydroxyphenyl)-3,5-dimethyl-4-bora-3a,4a-diaza-s-indacene |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H15BF2N2O |
| InChI |
InChI=1S/C17H15BF2N2O/c1-11-3-9-15-17(13-5-7-14(23)8-6-13)16-10-4-12(2)22(16)18(19,20)21(11)15/h3-10,23H,1-2H3 |
| InChIKey |
HEBAJODSDZDSKZ-UHFFFAOYSA-N |
| Molecular Weight |
312.127 g/mol |
| SMILES |
Oc1ccc(C=2c3[n]([B]([N]=4C2C=CC4C)(F)F)c(cc3)C)cc1 |
| SPLASH |
splash10-03dl-0079000000-140071040372980f3e14 |
| Source of Spectrum |
F-70-4156-2 |
| Synonyms |
4-(2,2-difluoro-4,12-dimethyl-1,3-diaza-2-boratricyclo[7.3.0.0(3,7)]dodeca-1(12),4,6,8,10-pentaen-8-yl)phenol |
| Wiley ID |
1596917 |
