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(2E)-3-(1,3-benzodioxol-5-yl)-N-(6-methyl-1,3-benzothiazol-2-yl)-2-propenamide

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(2E)-3-(1,3-benzodioxol-5-yl)-N-(6-methyl-1,3-benzothiazol-2-yl)-2-propenamide
SpectraBase Compound ID KQnylWbfkuZ
InChI InChI=1S/C18H14N2O3S/c1-11-2-5-13-16(8-11)24-18(19-13)20-17(21)7-4-12-3-6-14-15(9-12)23-10-22-14/h2-9H,10H2,1H3,(H,19,20,21)/b7-4+
InChIKey PHKCFJJKKFIYQZ-QPJJXVBHSA-N
Mol Weight 338.38 g/mol
Molecular Formula C18H14N2O3S
Exact Mass 338.072513 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ZbdkW8JrTg
Name (2E)-3-(1,3-Benzodioxol-5-yl)-N-(6-methyl-1,3-benzothiazol-2-yl)-2-propenamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 338.072513490 u
Formula C18H14N2O3S
InChI InChI=1S/C18H14N2O3S/c1-11-2-5-13-16(8-11)24-18(19-13)20-17(21)7-4-12-3-6-14-15(9-12)23-10-22-14/h2-9H,10H2,1H3,(H,19,20,21)/b7-4+
InChIKey PHKCFJJKKFIYQZ-QPJJXVBHSA-N
Molecular Weight 338.381 g/mol
SMILES N(C1=NC=2C=CC(=CC2S1)C)C(\C=C\C=1C=C2OCOC2=CC1)=O