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1-Benzyl-5-chloro-1H-benzimidazole-2-thiol, tms derivative

View entire compound with spectra: 1 NMR

1-Benzyl-5-chloro-1H-benzimidazole-2-thiol, tms derivative
SpectraBase Compound ID OLxrdtgbWF
InChI InChI=1S/C17H19ClN2SSi/c1-22(2,3)21-17-19-15-11-14(18)9-10-16(15)20(17)12-13-7-5-4-6-8-13/h4-11H,12H2,1-3H3
InChIKey JTWJMZXSJQDSST-UHFFFAOYSA-N
Mol Weight 346.95 g/mol
Molecular Formula C17H19ClN2SSi
Exact Mass 346.072674 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HloadJC1dTI
Name 1-Benzyl-5-chloro-1H-benzimidazole-2-thiol, tms derivative
Comments Computed using HOSE algorithm
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Exact Mass 346.072674029 u
Formula C17H19ClN2SSi
InChI InChI=1S/C17H19ClN2SSi/c1-22(2,3)21-17-19-15-11-14(18)9-10-16(15)20(17)12-13-7-5-4-6-8-13/h4-11H,12H2,1-3H3
InChIKey JTWJMZXSJQDSST-UHFFFAOYSA-N
Molecular Weight 346.951 g/mol
SMILES C=1(S[Si](C)(C)C)N(C2=C(N1)C=C(C=C2)Cl)CC1=CC=CC=C1