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Ethyl 3-[4-(trifluoromethylsulfonyloxy)phenyl]benzoate
SpectraBase Compound ID 47cXfDHclHC
InChI InChI=1S/C16H13F3O5S/c1-2-23-15(20)13-5-3-4-12(10-13)11-6-8-14(9-7-11)24-25(21,22)16(17,18)19/h3-10H,2H2,1H3
InChIKey RSILQWWUUJEEPO-UHFFFAOYSA-N
Mol Weight 374.33 g/mol
Molecular Formula C16H13F3O5S
Exact Mass 374.043579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID In1oyZ4gJz1
Name Ethyl 3-[4-(trifluoromethylsulfonyloxy)phenyl]benzoate
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13F3O5S
InChI InChI=1S/C16H13F3O5S/c1-2-23-15(20)13-5-3-4-12(10-13)11-6-8-14(9-7-11)24-25(21,22)16(17,18)19/h3-10H,2H2,1H3
InChIKey RSILQWWUUJEEPO-UHFFFAOYSA-N
Instrument Name GC-MS Agilent 5977B MSD
Ionization Type EI
Literature Reference DOI 10.1002/adsc.202200321
Molecular Weight 374.330 g/mol
Reported Formula C16H13F3O5S
SMILES c1c(ccc(c1)OS(C(F)(F)F)(=O)=O)-c1cccc(c1)C(=O)OCC
SPLASH splash10-0006-0491000000-5e1c776fd5aa1ba14fa4
Source of Spectrum ASC-364-SM23-3bk
Wiley ID 1872970