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2H-1,4-Oxazine-4-acetamide, tetrahydro-2,6-dimethyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-
SpectraBase Compound ID DPIfuxTe3jF
InChI InChI=1S/C22H25N3O2S/c1-14-4-9-19-20(10-14)28-22(24-19)17-5-7-18(8-6-17)23-21(26)13-25-11-15(2)27-16(3)12-25/h4-10,15-16H,11-13H2,1-3H3,(H,23,26)
InChIKey KTKFTSFARSWMII-UHFFFAOYSA-N
Mol Weight 395.52 g/mol
Molecular Formula C22H25N3O2S
Exact Mass 395.166748 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID sY6vuBwWIT
Name 2H-1,4-Oxazine-4-acetamide, tetrahydro-2,6-dimethyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 395.166748229 u
Formula C22H25N3O2S
InChI InChI=1S/C22H25N3O2S/c1-14-4-9-19-20(10-14)28-22(24-19)17-5-7-18(8-6-17)23-21(26)13-25-11-15(2)27-16(3)12-25/h4-10,15-16H,11-13H2,1-3H3,(H,23,26)
InChIKey KTKFTSFARSWMII-UHFFFAOYSA-N
Molecular Weight 395.521 g/mol
SMILES CC1CN(CC(C)O1)CC(NC1=CC=C(C=C1)C1=NC2=C(S1)C=C(C)C=C2)=O