| SpectraBase Spectrum ID |
6RQLMHobmKq |
| Name |
1-Naphthaldehyde, 4-(alpha,alpha,alpha,alpha',alpha',alpha'-hexafluoro)-3,5-xylyl-3-thiosemicarbazone |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
441.073437583 u |
| Formula |
C20H13F6N3S |
| InChI |
InChI=1S/C20H13F6N3S/c21-19(22,23)14-8-15(20(24,25)26)10-16(9-14)28-18(30)29-27-11-13-6-3-5-12-4-1-2-7-17(12)13/h1-11H,(H2,28,29,30)/b27-11+ |
| InChIKey |
AYVXOIOUKWJSQR-LUOAPIJWSA-N |
| Molecular Weight |
441.395 g/mol |
| SMILES |
N(\N=C\C=1C=2C=CC=CC2C=CC1)C(NC=1C=C(C=C(C1)C(F)(F)F)C(F)(F)F)=S |
