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acetic acid, (4-pentylphenoxy)-, 2-[(E)-[2-(hexyloxy)phenyl]methylidene]hydrazide
SpectraBase Compound ID LhehkFNxs2F
InChI InChI=1S/C26H36N2O3/c1-3-5-7-11-19-30-25-14-10-9-13-23(25)20-27-28-26(29)21-31-24-17-15-22(16-18-24)12-8-6-4-2/h9-10,13-18,20H,3-8,11-12,19,21H2,1-2H3,(H,28,29)/b27-20+
InChIKey URTDWESVJUELAQ-NHFJDJAPSA-N
Mol Weight 424.6 g/mol
Molecular Formula C26H36N2O3
Exact Mass 424.272593 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LHRAUTgdUyk
Name Acetic acid, (4-pentylphenoxy)-, 2-[(E)-[2-(hexyloxy)phenyl]methylidene]hydrazide
Comments Computed using HOSE algorithm
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Exact Mass 424.272593024 u
Formula C26H36N2O3
InChI InChI=1S/C26H36N2O3/c1-3-5-7-11-19-30-25-14-10-9-13-23(25)20-27-28-26(29)21-31-24-17-15-22(16-18-24)12-8-6-4-2/h9-10,13-18,20H,3-8,11-12,19,21H2,1-2H3,(H,28,29)/b27-20+
InChIKey URTDWESVJUELAQ-NHFJDJAPSA-N
Molecular Weight 424.585 g/mol
SMILES N(\N=C\C1=C(OCCCCCC)C=CC=C1)C(=O)COC1=CC=C(C=C1)CCCCC