SpectraBase Spectrum ID |
HtsBfUblrR0 |
Name |
Hexane-1,6-bis-(3-methyl-benzothiazol-3-ium) hexafluorophosphate salt |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C22H26F12N2P2S2 |
InChI |
InChI=1S/C22H26N2S2.2F6P/c1-23-17-11-7-9-13-19(17)25-21(23)15-5-3-4-6-16-22-24(2)18-12-8-10-14-20(18)26-22;2*1-7(2,3,4,5)6/h7-14H,3-6,15-16H2,1-2H3;;/q+2;2*-1 |
InChIKey |
NXWUVYDKPHXWMN-UHFFFAOYSA-N |
Molecular Weight |
672.512 g/mol |
SMILES |
[P-](F)(F)(F)(F)(F)F.c1([n+](c2c(s1)cccc2)C)CCCCCCc1[n+](c2ccccc2s1)C.[P-](F)(F)(F)(F)(F)F |
SPLASH |
splash10-014i-0918000000-11fc590c0227807476a9 |
Source of Spectrum |
QE-7-2755-12 |
Synonyms |
3-Methyl-2-[6-(3-methyl-1,3-benzothiazol-3-ium-2-yl)hexyl]-1,3-benzothiazol-3-ium dihexafluorophosphate
Hexane-1,6-bisbenzothiazolium hexafluorophosphate salt |
Wiley ID |
845855 |