| SpectraBase Spectrum ID |
IPxBAf00a1V |
| Name |
2,6-Dinitro-alpha,alpha,alpha-trifluoro-p-tolyl p-(methylthio)phenyl ether |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
374.018427056 u |
| Formula |
C14H9F3N2O5S |
| InChI |
InChI=1S/C14H9F3N2O5S/c1-25-10-4-2-9(3-5-10)24-13-11(18(20)21)6-8(14(15,16)17)7-12(13)19(22)23/h2-7H,1H3 |
| InChIKey |
HKXPWGSNAGHEPR-UHFFFAOYSA-N |
| Molecular Weight |
374.290 g/mol |
| SMILES |
N(=O)(=O)C1=C(C(=CC(=C1)C(F)(F)F)N(=O)=O)OC=1C=CC(=CC1)SC |
