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2-(1,3-benzoxazol-2-ylsulfanyl)-N'-((E)-{4-[(2-methylbenzyl)oxy]phenyl}methylidene)acetohydrazide
SpectraBase Compound ID EadQHMzMSYg
InChI InChI=1S/C24H21N3O3S/c1-17-6-2-3-7-19(17)15-29-20-12-10-18(11-13-20)14-25-27-23(28)16-31-24-26-21-8-4-5-9-22(21)30-24/h2-14H,15-16H2,1H3,(H,27,28)/b25-14+
InChIKey MYYZOKVRACCLNJ-AFUMVMLFSA-N
Mol Weight 431.51 g/mol
Molecular Formula C24H21N3O3S
Exact Mass 431.130363 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1eA950Z6y5v
Name 2-(1,3-Benzoxazol-2-ylsulfanyl)-N'-((E)-{4-[(2-methylbenzyl)oxy]phenyl}methylidene)acetohydrazide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 431.130362719 u
Formula C24H21N3O3S
InChI InChI=1S/C24H21N3O3S/c1-17-6-2-3-7-19(17)15-29-20-12-10-18(11-13-20)14-25-27-23(28)16-31-24-26-21-8-4-5-9-22(21)30-24/h2-14H,15-16H2,1H3,(H,27,28)/b25-14+
InChIKey MYYZOKVRACCLNJ-AFUMVMLFSA-N
Molecular Weight 431.510 g/mol
SMILES N(\N=C\C=1C=CC(OCC2=C(C)C=CC=C2)=CC1)C(CSC1=NC2=CC=CC=C2O1)=O