SpectraBase Spectrum ID |
KhGFn0WAcCr |
Name |
6,7-Diphenyl-S-methyldibenzo[bd]thiepinium Tetrafluoroborate |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C27H21BF4S |
InChI |
InChI=1S/C27H21S.BF4/c1-28-25-19-11-10-17-23(25)22-16-8-9-18-24(22)26(20-12-4-2-5-13-20)27(28)21-14-6-3-7-15-21;2-1(3,4)5/h2-19H,1H3;/q+1;-1 |
InChIKey |
HQYUJISICURXCH-UHFFFAOYSA-N |
Molecular Weight |
464.329 g/mol |
SMILES |
[B-](F)(F)(F)F.c1([s+](c2c(c3ccccc3c1-c1ccccc1)cccc2)C)-c1ccccc1 |
SPLASH |
splash10-03di-0009000000-5bdb485073402fe864c8 |
Source of Spectrum |
J-60-1012-8 |
Synonyms |
5-methyl-6,7-diphenylbenzo[d][1]benzothiepin-5-ium;tetrafluoroborate |
Wiley ID |
1391323 |