| SpectraBase Spectrum ID |
E8CF1ZdwSIU |
| Name |
Butyl-thiahelicene |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H18S4 |
| InChI |
InChI=1S/C26H18S4/c1-2-3-4-14-13-21-24(22-15-9-11-27-17(15)5-7-19(22)29-21)25-23-16-10-12-28-18(16)6-8-20(23)30-26(14)25/h5-13H,2-4H2,1H3 |
| InChIKey |
HXSXUFVYKJGCHQ-UHFFFAOYSA-N |
| Molecular Weight |
458.670 g/mol |
| SMILES |
c12c3c4c(ccc5c4ccs5)sc3cc(c2sc2c1c1c(scc1)cc2)CCCC |
| SPLASH |
splash10-0aor-0000900000-202ef3dab5668c88da2e |
| Source of Spectrum |
HE-2005-1141-9 |
| Wiley ID |
1613720 |
