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

*Links on SpectraBase are not permalinks.
(5S)-2,2-Bis(trifluoromethyl)-5-methyl-4-oxo-1,3-dioxolan-5-ylacetic acid
SpectraBase Compound ID KdoUCNqeBr7
InChI InChI=1S/C8H6F6O5/c1-5(2-3(15)16)4(17)18-6(19-5,7(9,10)11)8(12,13)14/h2H2,1H3,(H,15,16)/t5-/m0/s1
InChIKey ORGYBIMMTJGXQS-YFKPBYRVSA-N
Mol Weight 296.12 g/mol
Molecular Formula C8H6F6O5
Exact Mass 296.011942 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 JG5swPRGkGm
Name (5S)-2,2-Bis(trifluoromethyl)-5-methyl-4-oxo-1,3-dioxolan-5-ylacetic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6F6O5
InChI InChI=1S/C8H6F6O5/c1-5(2-3(15)16)4(17)18-6(19-5,7(9,10)11)8(12,13)14/h2H2,1H3,(H,15,16)/t5-/m0/s1
InChIKey ORGYBIMMTJGXQS-YFKPBYRVSA-N
Molecular Weight 296.121 g/mol
SMILES OC(C[C@@]1(OC(OC1=O)(C(F)(F)F)C(F)(F)F)C)=O
SPLASH splash10-000i-9010000000-7467ebd885d599f2bdbf
Source of Spectrum SO-0-1277-2
Synonyms [(4S)-4-methyl-5-oxo-2,2-bis(trifluoromethyl)-1,3-dioxolan-4-yl]acetic acid
Wiley ID 874054