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3,4,5-Trimethoxy-N-(6-methyl-benzothiazol-2-yl)-benzamide
SpectraBase Compound ID E3XQDLvepqz
InChI InChI=1S/C18H18N2O4S/c1-10-5-6-12-15(7-10)25-18(19-12)20-17(21)11-8-13(22-2)16(24-4)14(9-11)23-3/h5-9H,1-4H3,(H,19,20,21)
InChIKey JGBKEHZIPQQEDF-UHFFFAOYSA-N
Mol Weight 358.41 g/mol
Molecular Formula C18H18N2O4S
Exact Mass 358.098728 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LY9wsWoJUbI
Name 3,4,5-Trimethoxy-N-(6-methyl-benzothiazol-2-yl)-benzamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 358.098728238 u
Formula C18H18N2O4S
InChI InChI=1S/C18H18N2O4S/c1-10-5-6-12-15(7-10)25-18(19-12)20-17(21)11-8-13(22-2)16(24-4)14(9-11)23-3/h5-9H,1-4H3,(H,19,20,21)
InChIKey JGBKEHZIPQQEDF-UHFFFAOYSA-N
Molecular Weight 358.412 g/mol
SMILES C(NC=1SC=2C=C(C)C=CC2N1)(=O)C1=CC(OC)=C(OC)C(=C1)OC