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2-Thiazolamine, N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(2-pyridinyl)-
SpectraBase Compound ID 9Gjs1dEEgmr
InChI InChI=1S/C18H19N3O2S/c1-22-16-7-6-13(11-17(16)23-2)8-10-20-18-21-15(12-24-18)14-5-3-4-9-19-14/h3-7,9,11-12H,8,10H2,1-2H3,(H,20,21)
InChIKey BDLCSHBZBWDQAS-UHFFFAOYSA-N
Mol Weight 341.43 g/mol
Molecular Formula C18H19N3O2S
Exact Mass 341.119798 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F7RDRf5ttLb
Name 2-Thiazolamine, N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(2-pyridinyl)-
Comments Computed using HOSE algorithm
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Exact Mass 341.119798036 u
Formula C18H19N3O2S
InChI InChI=1S/C18H19N3O2S/c1-22-16-7-6-13(11-17(16)23-2)8-10-20-18-21-15(12-24-18)14-5-3-4-9-19-14/h3-7,9,11-12H,8,10H2,1-2H3,(H,20,21)
InChIKey BDLCSHBZBWDQAS-UHFFFAOYSA-N
Molecular Weight 341.429 g/mol
SMILES C1=CC=NC(C=2N=C(NCCC=3C=C(OC)C(=CC3)OC)SC2)=C1