| SpectraBase Spectrum ID |
7muQp75kzPI |
| Name |
2,3,4-trichloro-5,6-bis(trifluoromethylthio)benzoic acid methyl ester |
| CAS Registry Number |
114861-70-0 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C10H3Cl3F6O2S2 |
| InChI |
InChI=1S/C10H3Cl3F6O2S2/c1-21-8(20)2-3(11)4(12)5(13)7(23-10(17,18)19)6(2)22-9(14,15)16/h1H3 |
| InChIKey |
ATVVUUGNBUYPHB-UHFFFAOYSA-N |
| Molecular Weight |
439.601 g/mol |
| SMILES |
c1(c(c(SC(F)(F)F)c(c(c1Cl)Cl)Cl)SC(F)(F)F)C(=O)OC |
| SPLASH |
splash10-00di-0009300000-c4f5f512120ca4959800 |
| Source of Spectrum |
K-121-1838-4 |
| Synonyms |
methyl 2,3,4-tris(chloranyl)-5,6-bis(trifluoromethylsulfanyl)benzoate |
| Wiley ID |
1383904 |
