| SpectraBase Spectrum ID |
8tQCnMyuXGb |
| Name |
1,3,3,4,4-Pentafluoro-2-[(heptafluorocyclobutyl)sulfanyl]cyclobutene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
355.952909130 u |
| Formula |
C8F12S |
| InChI |
InChI=1S/C8F12S/c9-1-2(4(12,13)3(1,10)11)21-8(20)6(16,17)5(14,15)7(8,18)19 |
| InChIKey |
IFFGUKFTHIJXCD-UHFFFAOYSA-N |
| Molecular Weight |
356.129 g/mol |
| SMILES |
C1(=C(SC2(C(C(C2(F)F)(F)F)(F)F)F)C(C1(F)F)(F)F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.852964 |
![1,3,3,4,4-Pentafluoro-2-[(heptafluorocyclobutyl)sulfanyl]cyclobutene](/api/spectrum/8tQCnMyuXGb/structure.png?h=300&w=458 "1,3,3,4,4-Pentafluoro-2-[(heptafluorocyclobutyl)sulfanyl]cyclobutene")
