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acetic acid, [(4,6-dimethyl-2-pyrimidinyl)thio]-, 2-[(Z)-(3-ethoxy-2-hydroxyphenyl)methylidene]hydrazide
SpectraBase Compound ID BUIiQoXmmrA
InChI InChI=1S/C17H20N4O3S/c1-4-24-14-7-5-6-13(16(14)23)9-18-21-15(22)10-25-17-19-11(2)8-12(3)20-17/h5-9,23H,4,10H2,1-3H3,(H,21,22)/b18-9-
InChIKey DQOSPBFFYNPJPA-NVMNQCDNSA-N
Mol Weight 360.43 g/mol
Molecular Formula C17H20N4O3S
Exact Mass 360.125612 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BEnlqtOBTdI
Name Acetic acid, [(4,6-dimethyl-2-pyrimidinyl)thio]-, 2-[(Z)-(3-ethoxy-2-hydroxyphenyl)methylidene]hydrazide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 360.125611691 u
Formula C17H20N4O3S
InChI InChI=1S/C17H20N4O3S/c1-4-24-14-7-5-6-13(16(14)23)9-18-21-15(22)10-25-17-19-11(2)8-12(3)20-17/h5-9,23H,4,10H2,1-3H3,(H,21,22)/b18-9-
InChIKey DQOSPBFFYNPJPA-NVMNQCDNSA-N
Molecular Weight 360.432 g/mol
SMILES N(\N=C/C=1C(=C(C=CC1)OCC)O)C(CSC1=NC(C)=CC(=N1)C)=O