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3-Methoxy-4-(1-dimethylaminonaphthalene-5-sulfonyloxy)benzaldehyde

View entire compound with spectra: 1 NMR

3-Methoxy-4-(1-dimethylaminonaphthalene-5-sulfonyloxy)benzaldehyde
SpectraBase Compound ID 2qA5mwI62sO
InChI InChI=1S/C20H19NO5S/c1-21(2)17-8-4-7-16-15(17)6-5-9-20(16)27(23,24)26-18-11-10-14(13-22)12-19(18)25-3/h4-13H,1-3H3
InChIKey FCKSIRWWRIOBPQ-UHFFFAOYSA-N
Mol Weight 385.43 g/mol
Molecular Formula C20H19NO5S
Exact Mass 385.098394 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2YBHBaGNnsD
Name 3-Methoxy-4-(1-dimethylaminonaphthalene-5-sulfonyloxy)benzaldehyde
Comments Computed using HOSE algorithm
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Exact Mass 385.098393885 u
Formula C20H19NO5S
InChI InChI=1S/C20H19NO5S/c1-21(2)17-8-4-7-16-15(17)6-5-9-20(16)27(23,24)26-18-11-10-14(13-22)12-19(18)25-3/h4-13H,1-3H3
InChIKey FCKSIRWWRIOBPQ-UHFFFAOYSA-N
Molecular Weight 385.434 g/mol
SMILES COC1=CC(C=O)=CC=C1OS(=O)(=O)C1=C2C=CC=C(N(C)C)C2=CC=C1