| SpectraBase Spectrum ID |
9JbwoATZCJo |
| Name |
3-Methyl-5-methylthio-7,8-dihydro-6H-benzocyclohepta[2,1-d]thiazolo[3,2-a]pyridinium tetrafluoroborate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H18BF4NS2 |
| InChI |
InChI=1S/C18H18NS2.BF4/c1-12-6-7-13-4-3-5-14-11-16-19(8-9-21-16)18(20-2)17(14)15(13)10-12;2-1(3,4)5/h6-11H,3-5H2,1-2H3;/q+1;-1 |
| InChIKey |
WJSHNEDVNZXHSY-UHFFFAOYSA-N |
| Molecular Weight |
399.273 g/mol |
| SMILES |
[B-](F)(F)(F)F.c1([n+]2c(cc3CCCc4c(-c13)cc(cc4)C)scc2)SC |
| SPLASH |
splash10-0002-0093000000-00e70d00884e274b8a1d |
| Source of Spectrum |
F-46-4300-10 |
| Synonyms |
2-methyl-13-(methylsulfanyl)-5H,6H,7H-benzo[3,4]cyclohepta[1,2-d][1,3]thiazolo[3,2-a]pyridin-12-ium tetrafluoroborate |
| Wiley ID |
1368890 |
![3-Methyl-5-methylthio-7,8-dihydro-6H-benzocyclohepta[2,1-d]thiazolo[3,2-a]pyridinium tetrafluoroborate](/api/spectrum/9JbwoATZCJo/structure.png?h=300&w=458 "3-Methyl-5-methylthio-7,8-dihydro-6H-benzocyclohepta[2,1-d]thiazolo[3,2-a]pyridinium tetrafluoroborate")
