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Pentafluorobenzyl heptadeuterioisobutanoate
SpectraBase Compound ID 7t0y49Ulu6R
InChI InChI=1S/C11H9F5O2/c1-4(2)11(17)18-3-5-6(12)8(14)10(16)9(15)7(5)13/h4H,3H2,1-2H3/i1D3,2D3,4D
InChIKey DZHXAKOYPKOEDU-UAVYNJCWSA-N
Mol Weight 275.23 g/mol
Molecular Formula C11H2D7F5O2
Exact Mass 275.096208 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HU8ehCgqGSg
Name Pentafluorobenzyl heptadeuterioisobutanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H2D7F5O2
InChI InChI=1S/C11H9F5O2/c1-4(2)11(17)18-3-5-6(12)8(14)10(16)9(15)7(5)13/h4H,3H2,1-2H3/i1D3,2D3,4D
InChIKey DZHXAKOYPKOEDU-UAVYNJCWSA-N
Molecular Weight 275.226 g/mol
SMILES C(C([D])([D])[D])(C([D])([D])[D])(C(OCc1c(c(c(F)c(c1F)F)F)F)=O)[D]
SPLASH splash10-0f89-5910000000-d9644e37b2c56f72193c
Source of Spectrum AT-32-4851-7
Wiley ID 835961