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1H-tetrazole, 5-[[2-(4-ethoxyphenoxy)ethyl]thio]-1-phenyl-

View entire compound with spectra: 2 NMR

1H-tetrazole, 5-[[2-(4-ethoxyphenoxy)ethyl]thio]-1-phenyl-
SpectraBase Compound ID BfAUaE32uTU
InChI InChI=1S/C17H18N4O2S/c1-2-22-15-8-10-16(11-9-15)23-12-13-24-17-18-19-20-21(17)14-6-4-3-5-7-14/h3-11H,2,12-13H2,1H3
InChIKey DPFSXIVYNLCXFE-UHFFFAOYSA-N
Mol Weight 342.42 g/mol
Molecular Formula C17H18N4O2S
Exact Mass 342.115047 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FWMeXEWXI0k
Name 1H-Tetrazole, 5-[[2-(4-ethoxyphenoxy)ethyl]thio]-1-phenyl-
Comments Computed using HOSE algorithm
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Exact Mass 342.115047008 u
Formula C17H18N4O2S
InChI InChI=1S/C17H18N4O2S/c1-2-22-15-8-10-16(11-9-15)23-12-13-24-17-18-19-20-21(17)14-6-4-3-5-7-14/h3-11H,2,12-13H2,1H3
InChIKey DPFSXIVYNLCXFE-UHFFFAOYSA-N
Molecular Weight 342.417 g/mol
SMILES C1=CC=C(N2C(=NN=N2)SCCOC2=CC=C(C=C2)OCC)C=C1