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(2-Amino-4-phenyl-1,3-thiazol-5-yl)acetic acid, 3tms derivative
SpectraBase Compound ID fXEU5WcLua
InChI InChI=1S/C20H34N2O2SSi3/c1-26(2,3)22(27(4,5)6)20-21-19(16-13-11-10-12-14-16)17(25-20)15-18(23)24-28(7,8)9/h10-14H,15H2,1-9H3
InChIKey KZBRLNFNVDEBOP-UHFFFAOYSA-N
Mol Weight 450.8 g/mol
Molecular Formula C20H34N2O2SSi3
Exact Mass 450.164879 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I8HXEynFUca
Name (2-Amino-4-phenyl-1,3-thiazol-5-yl)acetic acid, 3tms derivative
Comments Computed using HOSE algorithm
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Exact Mass 450.164879120 u
Formula C20H34N2O2SSi3
InChI InChI=1S/C20H34N2O2SSi3/c1-26(2,3)22(27(4,5)6)20-21-19(16-13-11-10-12-14-16)17(25-20)15-18(23)24-28(7,8)9/h10-14H,15H2,1-9H3
InChIKey KZBRLNFNVDEBOP-UHFFFAOYSA-N
Molecular Weight 450.819 g/mol
SMILES C[Si](C)(C)N([Si](C)(C)C)C1=NC(C2=CC=CC=C2)=C(CC(O[Si](C)(C)C)=O)S1