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1,3-Dimethyl-5-(2,3-bis(perdeuteriotrimethylsilyloxy)propyl)-5-(1-methylbutyl)barbituric acid
SpectraBase Compound ID Ldyyqf5vZjA
InChI InChI=1S/C20H40N2O5Si2/c1-11-12-15(2)20(17(23)21(3)19(25)22(4)18(20)24)13-16(27-29(8,9)10)14-26-28(5,6)7/h15-16H,11-14H2,1-10H3/i5D3,6D3,7D3,8D3,9D3,10D3
InChIKey AADQGUNTBKFXBE-YGLCDEMRSA-N
Mol Weight 462.83 g/mol
Molecular Formula C20H222D18N2O5Si2
Exact Mass 462.360557 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9fBKY9a8Cup
Name 1,3-Dimethyl-5-(2,3-bis(perdeuteriotrimethylsilyloxy)propyl)-5-(1-methylbutyl)barbituric acid
CAS Registry Number 55401-60-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22D18N2O5Si2
InChI InChI=1S/C20H40N2O5Si2/c1-11-12-15(2)20(17(23)21(3)19(25)22(4)18(20)24)13-16(27-29(8,9)10)14-26-28(5,6)7/h15-16H,11-14H2,1-10H3/i5D3,6D3,7D3,8D3,9D3,10D3
InChIKey AADQGUNTBKFXBE-YGLCDEMRSA-N
Molecular Weight 462.829 g/mol
SMILES C1(C(N(C)C(N(C1=O)C)=O)=O)(CC(O[Si](C([2D])([2D])[2D])(C([2D])([2D])[2D])C([2D])([2D])[2D])CO[Si](C([2D])([2D])[2D])(C([2D])([2D])[2D])C([2D])([2D])[2D])C(CCC)C
SPLASH splash10-001i-9000000000-1b40a373ed2df29d9592
Source of Spectrum CR-224-0-0
Synonyms Dihydroxysecobarbital di-D9-TMS ether 1,3-dimethyl derivative
Wiley ID 1385892