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 |