| SpectraBase Spectrum ID |
59NI1sUrgLP |
| Name |
1H-3-Iodo-4-(4-methoxybenzylthio)-6-methoxybenzothiopyrylium tetrafluoroborate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H16BF4IO2S2 |
| InChI |
InChI=1S/C18H16IO2S2.BF4/c1-20-13-5-3-12(4-6-13)10-23-18-15-9-14(21-2)7-8-17(15)22-11-16(18)19;2-1(3,4)5/h3-9,11H,10H2,1-2H3;/q+1;-1 |
| InChIKey |
NASPDGALGWRXBX-UHFFFAOYSA-N |
| Molecular Weight |
542.152 g/mol |
| SMILES |
[B-](F)(F)(F)F.c12c(SCc3ccc(OC)cc3)c(c[s+]c1ccc(c2)OC)I |
| SPLASH |
splash10-0kmi-0952400000-66e19d33a17b3837a31a |
| Source of Spectrum |
J-63-4631-4 |
| Synonyms |
3-iodo-6-methoxy-4-[(4-methoxybenzyl)sulfanyl]-1-benzothiopyranium tetrafluoroborate |
| Wiley ID |
1404781 |
