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[2,3,5,6-tetradeuterio-4-[2,2,2-trideuterio-1-[2,3,5,6-tetradeuterio-4-(2,2,2-trifluoroacetyl)oxy-phenyl]-1-(trideuteriomethyl)ethyl]phenyl] 2,2,2-trifluoroacetate

View entire compound with spectra: 1 MS (GC)

[2,3,5,6-tetradeuterio-4-[2,2,2-trideuterio-1-[2,3,5,6-tetradeuterio-4-(2,2,2-trifluoroacetyl)oxy-phenyl]-1-(trideuteriomethyl)ethyl]phenyl] 2,2,2-trifluoroacetate
SpectraBase Compound ID ADMQgTVszZd
InChI InChI=1S/C19H14F6O4/c1-17(2,11-3-7-13(8-4-11)28-15(26)18(20,21)22)12-5-9-14(10-6-12)29-16(27)19(23,24)25/h3-10H,1-2H3/i1D3,2D3,3D,4D,5D,6D,7D,8D,9D,10D
InChIKey ZJCTXFUHOQIFKR-DDAUHAMOSA-N
Mol Weight 434.39 g/mol
Molecular Formula C19D14F6O4
Exact Mass 434.167502 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LGmO4m83jRW
Name [2,3,5,6-tetradeuterio-4-[2,2,2-trideuterio-1-[2,3,5,6-tetradeuterio-4-(2,2,2-trifluoroacetyl)oxy-phenyl]-1-(trideuteriomethyl)ethyl]phenyl] 2,2,2-trifluoroacetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19D14F6O4
InChI InChI=1S/C19H14F6O4/c1-17(2,11-3-7-13(8-4-11)28-15(26)18(20,21)22)12-5-9-14(10-6-12)29-16(27)19(23,24)25/h3-10H,1-2H3/i1D3,2D3,3D,4D,5D,6D,7D,8D,9D,10D
InChIKey ZJCTXFUHOQIFKR-DDAUHAMOSA-N
Instrument Name shimadzu QP2010SE
Ionization Type EI
Literature Reference DOI 10.1002/rcm.8860
Molecular Weight 434.393 g/mol
SMILES c1(c(c(c(c(c1OC(C(F)(F)F)=O)[D])[D])C(c1c(c(c(c(c1[D])[D])OC(=O)C(F)(F)F)[D])[D])(C([D])([D])[D])C([D])([D])[D])[D])[D]
SPLASH splash10-014i-4520900000-19865421f46c06c277f5
Source of Spectrum RCM-34-5-BPA-d14 di-TFA
Wiley ID 1840366