| SpectraBase Spectrum ID |
7EsUFSIzhJK |
| Name |
1,6-Dithia-3,8-diazaspiro[4.4]nona-2,8-diene, 4,4-dimethyl-2,9-diphenyl-7,7-bis(trifluoromethyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
474.065909849 u |
| Formula |
C21H16F6N2S2 |
| InChI |
InChI=1S/C21H16F6N2S2/c1-17(2)18(30-16(29-17)14-11-7-4-8-12-14)15(13-9-5-3-6-10-13)28-19(31-18,20(22,23)24)21(25,26)27/h3-12H,1-2H3 |
| InChIKey |
SASGLCUUHNUGCL-UHFFFAOYSA-N |
| Molecular Weight |
474.483 g/mol |
| SMILES |
C12(SC(C(F)(F)F)(C(F)(F)F)N=C2C2=CC=CC=C2)SC(C=2C=CC=CC2)=NC1(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.813455 |
![1,6-Dithia-3,8-diazaspiro[4.4]nona-2,8-diene, 4,4-dimethyl-2,9-diphenyl-7,7-bis(trifluoromethyl)-](/api/spectrum/7EsUFSIzhJK/structure.png?h=300&w=458 "1,6-Dithia-3,8-diazaspiro[4.4]nona-2,8-diene, 4,4-dimethyl-2,9-diphenyl-7,7-bis(trifluoromethyl)-")
