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5-[(4-Chlorophenoxy)ethyl]-1,3,4-thiadiazole-2-ylamine, 2tms

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5-[(4-Chlorophenoxy)ethyl]-1,3,4-thiadiazole-2-ylamine, 2tms
SpectraBase Compound ID 3tYvbbKXUMg
InChI InChI=1S/C16H26ClN3OSSi2/c1-12(21-14-10-8-13(17)9-11-14)15-18-19-16(22-15)20(23(2,3)4)24(5,6)7/h8-12H,1-7H3
InChIKey OLGRAFTWKFCMBM-UHFFFAOYSA-N
Mol Weight 400.09 g/mol
Molecular Formula C16H26ClN3OSSi2
Exact Mass 399.102364 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EJjen1w2Ezm
Name 5-[(4-Chlorophenoxy)ethyl]-1,3,4-thiadiazole-2-ylamine, 2tms
Comments Computed using HOSE algorithm
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Exact Mass 399.102364412 u
Formula C16H26ClN3OSSi2
InChI InChI=1S/C16H26ClN3OSSi2/c1-12(21-14-10-8-13(17)9-11-14)15-18-19-16(22-15)20(23(2,3)4)24(5,6)7/h8-12H,1-7H3
InChIKey OLGRAFTWKFCMBM-UHFFFAOYSA-N
Molecular Weight 400.087 g/mol
SMILES C=1(SC(=NN1)C(C)OC1=CC=C(C=C1)Cl)N([Si](C)(C)C)[Si](C)(C)C