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benzenesulfonic acid, 4-methyl-, 2-[(E)-[2-(hexyloxy)phenyl]methylidene]hydrazide
SpectraBase Compound ID 9f3j9eMmj46
InChI InChI=1S/C20H26N2O3S/c1-3-4-5-8-15-25-20-10-7-6-9-18(20)16-21-22-26(23,24)19-13-11-17(2)12-14-19/h6-7,9-14,16,22H,3-5,8,15H2,1-2H3/b21-16+
InChIKey NZAHLQVQFZURJT-LTGZKZEYSA-N
Mol Weight 374.5 g/mol
Molecular Formula C20H26N2O3S
Exact Mass 374.166414 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1qB4Yg7Lwuw
Name Benzenesulfonic acid, 4-methyl-, 2-[(E)-[2-(hexyloxy)phenyl]methylidene]hydrazide
Comments Computed using HOSE algorithm
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Exact Mass 374.166413876 u
Formula C20H26N2O3S
InChI InChI=1S/C20H26N2O3S/c1-3-4-5-8-15-25-20-10-7-6-9-18(20)16-21-22-26(23,24)19-13-11-17(2)12-14-19/h6-7,9-14,16,22H,3-5,8,15H2,1-2H3/b21-16+
InChIKey NZAHLQVQFZURJT-LTGZKZEYSA-N
Molecular Weight 374.499 g/mol
SMILES N(S(C=1C=CC(=CC1)C)(=O)=O)\N=C\C1=C(OCCCCCC)C=CC=C1