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3-benzoyl-2-methyl-1,1-dioxido-2H-1,2-benzothiazin-4-yl 2-(acetyloxy)benzoate

View entire compound with spectra: 2 NMR

3-benzoyl-2-methyl-1,1-dioxido-2H-1,2-benzothiazin-4-yl 2-(acetyloxy)benzoate
SpectraBase Compound ID 47p7ix3jcHD
InChI InChI=1S/C25H19NO7S/c1-16(27)32-20-14-8-6-12-18(20)25(29)33-24-19-13-7-9-15-21(19)34(30,31)26(2)22(24)23(28)17-10-4-3-5-11-17/h3-15H,1-2H3
InChIKey YAVUUVQYUDIUOL-UHFFFAOYSA-N
Mol Weight 477.49 g/mol
Molecular Formula C25H19NO7S
Exact Mass 477.088223 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EgkCz6wkyTP
Name 3-Benzoyl-2-methyl-1,1-dioxido-2H-1,2-benzothiazin-4-yl 2-(acetyloxy)benzoate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 477.088223123 u
Formula C25H19NO7S
InChI InChI=1S/C25H19NO7S/c1-16(27)32-20-14-8-6-12-18(20)25(29)33-24-19-13-7-9-15-21(19)34(30,31)26(2)22(24)23(28)17-10-4-3-5-11-17/h3-15H,1-2H3
InChIKey YAVUUVQYUDIUOL-UHFFFAOYSA-N
Molecular Weight 477.487 g/mol
SMILES C1=CC=C(C(C=2N(S(C=3C(C2OC(C=2C(OC(=O)C)=CC=CC2)=O)=CC=CC3)(=O)=O)C)=O)C=C1