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2-[5,7-Methoxy-1-oxo-3-n-propylisoquinolin-2(1H)-yl]-pyridine-2-oxide
SpectraBase Compound ID 5BBIDhFPYjn
InChI InChI=1S/C19H20N2O4/c1-4-7-13-10-15-16(11-14(24-2)12-17(15)25-3)19(22)21(13)18-8-5-6-9-20(18)23/h5-6,8-12H,4,7H2,1-3H3
InChIKey QNZCRLXCFQKONS-UHFFFAOYSA-N
Mol Weight 340.38 g/mol
Molecular Formula C19H20N2O4
Exact Mass 340.142307 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FJ5W9obAFxj
Name 2-[5,7-Methoxy-1-oxo-3-n-propylisoquinolin-2(1H)-yl]-pyridine-2-oxide
Appearance Yellow oil
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Exact Mass 340.142307128 u
Formula C19H20N2O4
InChI InChI=1S/C19H20N2O4/c1-4-7-13-10-15-16(11-14(24-2)12-17(15)25-3)19(22)21(13)18-8-5-6-9-20(18)23/h5-6,8-12H,4,7H2,1-3H3
InChIKey QNZCRLXCFQKONS-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI
Literature Reference DOI 10.1002/anie.201712647
Molecular Weight 340.379 g/mol
Quality 156
Reported Formula C19H20N2O4
SMILES C12=C(C=C(N(C2=O)C=2[N+](=CC=CC2)[O-])CCC)C(=CC(=C1)OC)OC
SPLASH splash10-002e-3985000000-46f9a3fa689824d49cf3
Source of Spectrum ACI-57-SM20-3nf (DOI: 10.1002/anie.201712647)
Wiley ID 1891224