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acetamide, 2-(2-chlorophenoxy)-N-[4-(4-oxo-4H-3,1-benzoxazin-2-yl)phenyl]-
SpectraBase Compound ID 48Gd84sIeWe
InChI InChI=1S/C22H15ClN2O4/c23-17-6-2-4-8-19(17)28-13-20(26)24-15-11-9-14(10-12-15)21-25-18-7-3-1-5-16(18)22(27)29-21/h1-12H,13H2,(H,24,26)
InChIKey BJUOKYNQCFFUTE-UHFFFAOYSA-N
Mol Weight 406.83 g/mol
Molecular Formula C22H15ClN2O4
Exact Mass 406.072035 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7LNxtqIa92J
Name Acetamide, 2-(2-chlorophenoxy)-N-[4-(4-oxo-4H-3,1-benzoxazin-2-yl)phenyl]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 406.072034667 u
Formula C22H15ClN2O4
InChI InChI=1S/C22H15ClN2O4/c23-17-6-2-4-8-19(17)28-13-20(26)24-15-11-9-14(10-12-15)21-25-18-7-3-1-5-16(18)22(27)29-21/h1-12H,13H2,(H,24,26)
InChIKey BJUOKYNQCFFUTE-UHFFFAOYSA-N
Molecular Weight 406.825 g/mol
SMILES N(C(=O)COC1=C(Cl)C=CC=C1)C=1C=CC(C2=NC3=CC=CC=C3C(O2)=O)=CC1