| SpectraBase Spectrum ID |
8mzUQC9YZ4S |
| Name |
3,3-BIS(HYDROXYMETHYL)-2,3-DIHYDRO-4H-1-BENZOTHIOPYRAN-4-ONE, BIS(alpha,alpha,alpha-TRIFLUORO-m-TOLUATE) |
| Source of Sample |
Bionet Research Ltd., Cornwall, England |
| Copyright |
Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H18F6O5S |
| InChI |
InChI=1S/C27H18F6O5S/c28-26(29,30)18-7-3-5-16(11-18)23(35)37-13-25(15-39-21-10-2-1-9-20(21)22(25)34)14-38-24(36)17-6-4-8-19(12-17)27(31,32)33/h1-12H,13-15H2 |
| InChIKey |
XYCWMYAPKRNGDE-UHFFFAOYSA-N |
| Instrument Name |
BRUKER AC-300 |
| Melting Point |
130-132C |
| Molecular Weight |
568.49 |
| Solvent |
CDCl3; Reference=TMS; Temperature 297K |
