SpectraBase Spectrum ID |
E5txNlmDHOv |
Name |
1-Bromo-5-(difluoromethoxy)pentan-3-yl 4-methylbenzenesulfonate |
Appearance |
Colorless oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
385.999899523 u |
Formula |
C13H17BrF2O4S |
InChI |
InChI=1S/C13H17BrF2O4S/c1-10-2-4-12(5-3-10)21(17,18)20-11(6-8-14)7-9-19-13(15)16/h2-5,11,13H,6-9H2,1H3 |
InChIKey |
FJPTWOKKPYDOQT-UHFFFAOYSA-N |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/chem.202103428 |
Molecular Weight |
387.236 g/mol |
Quality |
3 |
Reported Formula |
C13H17BrF2O4S |
SMILES |
C(Br)CC(CCOC(F)F)OS(C1=CC=C(C=C1)C)(=O)=O |
SPLASH |
splash10-0a4i-0900000000-bc151201912e5437685b |
Source of Spectrum |
QE-27-SM33-2ae (DOI: 10.1002/chem.202103428) |
Wiley ID |
1904298 |