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1-(4-Methoxyphenyl)-1H-tetrazole-5-thiol, tms derivative
SpectraBase Compound ID L9BpLKwinsF
InChI InChI=1S/C11H16N4OSSi/c1-16-10-7-5-9(6-8-10)15-11(12-13-14-15)17-18(2,3)4/h5-8H,1-4H3
InChIKey NPOVDOKWDDKYJO-UHFFFAOYSA-N
Mol Weight 280.42 g/mol
Molecular Formula C11H16N4OSSi
Exact Mass 280.081409 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JN1GBxxHXJL
Name 1-(4-Methoxyphenyl)-1H-tetrazole-5-thiol, tms derivative
Comments Computed using HOSE algorithm
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Exact Mass 280.081408859 u
Formula C11H16N4OSSi
InChI InChI=1S/C11H16N4OSSi/c1-16-10-7-5-9(6-8-10)15-11(12-13-14-15)17-18(2,3)4/h5-8H,1-4H3
InChIKey NPOVDOKWDDKYJO-UHFFFAOYSA-N
Molecular Weight 280.421 g/mol
SMILES C=1(S[Si](C)(C)C)N(N=NN1)C1=CC=C(C=C1)OC