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acetic acid, [(1-ethyl-1H-benzimidazol-2-yl)thio]-, 2-[(E)-1-(3-bromophenyl)ethylidene]hydrazide
SpectraBase Compound ID KpNvfY3BOOI
InChI InChI=1S/C19H19BrN4OS/c1-3-24-17-10-5-4-9-16(17)21-19(24)26-12-18(25)23-22-13(2)14-7-6-8-15(20)11-14/h4-11H,3,12H2,1-2H3,(H,23,25)/b22-13+
InChIKey RVOWEGNCSSHQJO-LPYMAVHISA-N
Mol Weight 431.35 g/mol
Molecular Formula C19H19BrN4OS
Exact Mass 430.046295 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9hh4hKF3ir2
Name Acetic acid, [(1-ethyl-1H-benzimidazol-2-yl)thio]-, 2-[(E)-1-(3-bromophenyl)ethylidene]hydrazide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 430.046295421 u
Formula C19H19BrN4OS
InChI InChI=1S/C19H19BrN4OS/c1-3-24-17-10-5-4-9-16(17)21-19(24)26-12-18(25)23-22-13(2)14-7-6-8-15(20)11-14/h4-11H,3,12H2,1-2H3,(H,23,25)/b22-13+
InChIKey RVOWEGNCSSHQJO-LPYMAVHISA-N
Molecular Weight 431.352 g/mol
SMILES N(\N=C\(C1=CC(Br)=CC=C1)C)C(CSC1=NC=2C=CC=CC2N1CC)=O