For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
5-iso-Propyl-2-methylphenyl trifluoromethanesulfonate
SpectraBase Compound ID D5v6e8FMmN4
InChI InChI=1S/C11H13F3O3S/c1-7(2)9-5-4-8(3)10(6-9)17-18(15,16)11(12,13)14/h4-7H,1-3H3
InChIKey SYVLUOVNTLERIV-UHFFFAOYSA-N
Mol Weight 282.28 g/mol
Molecular Formula C11H13F3O3S
Exact Mass 282.05375 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 4IJSjS3qYkP
Name 5-iso-Propyl-2-methylphenyl trifluoromethanesulfonate
Appearance Yellowish oil
Carrier Gas Hydrogen
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 282.053749939 u
Formula C11H13F3O3S
GC Oven Program Oven temp 300 oC
InChI InChI=1S/C11H13F3O3S/c1-7(2)9-5-4-8(3)10(6-9)17-18(15,16)11(12,13)14/h4-7H,1-3H3
InChIKey SYVLUOVNTLERIV-UHFFFAOYSA-N
Instrument Name Agilent GC6890-HP 5973
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202200058
Molecular Weight 282.277 g/mol
Quality 401
SMILES C=1C=C(C)C(OS(C(F)(F)F)(=O)=O)=CC1C(C)C
SPLASH splash10-014i-3590000000-3856b38dc742836746a1
Source of Spectrum K1-2022-SM3-9 (DOI: 10.1002/ejoc.202200058)
Thin-Layer Chromatography 0.5 (SiO2, cHex/EtOAc, 50:1)
Wiley ID 1898702