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(2E)-N-(6-methoxy-1,3-benzothiazol-2-yl)-3-phenyl-2-propenamide
SpectraBase Compound ID JM0w6iWcIAM
InChI InChI=1S/C17H14N2O2S/c1-21-13-8-9-14-15(11-13)22-17(18-14)19-16(20)10-7-12-5-3-2-4-6-12/h2-11H,1H3,(H,18,19,20)/b10-7+
InChIKey MMURPMJHHIRRJA-JXMROGBWSA-N
Mol Weight 310.37 g/mol
Molecular Formula C17H14N2O2S
Exact Mass 310.077599 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3cEzcB8Cw6D
Name (2E)-N-(6-Methoxy-1,3-benzothiazol-2-yl)-3-phenyl-2-propenamide
Comments Computed using HOSE algorithm
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Exact Mass 310.077598871 u
Formula C17H14N2O2S
InChI InChI=1S/C17H14N2O2S/c1-21-13-8-9-14-15(11-13)22-17(18-14)19-16(20)10-7-12-5-3-2-4-6-12/h2-11H,1H3,(H,18,19,20)/b10-7+
InChIKey MMURPMJHHIRRJA-JXMROGBWSA-N
Molecular Weight 310.371 g/mol
SMILES N(C1=NC2=CC=C(C=C2S1)OC)C(\C=C\C1=CC=CC=C1)=O