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2-[3-(2-(Benzoyloxy)ethyl)-1-oxoisoquinolin-2(1H)-yl]pyridine 1-oxide
SpectraBase Compound ID LHpegtgGodf
InChI InChI=1S/C23H18N2O4/c26-22-20-11-5-4-10-18(20)16-19(25(22)21-12-6-7-14-24(21)28)13-15-29-23(27)17-8-2-1-3-9-17/h1-12,14,16H,13,15H2
InChIKey SNDUWQZVFCMTNK-UHFFFAOYSA-N
Mol Weight 386.41 g/mol
Molecular Formula C23H18N2O4
Exact Mass 386.126657 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GY98FpevMvt
Name 2-[3-(2-(Benzoyloxy)ethyl)-1-oxoisoquinolin-2(1H)-yl]pyridine 1-oxide
Appearance Colorless solid
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Exact Mass 386.126657064 u
Formula C23H18N2O4
InChI InChI=1S/C23H18N2O4/c26-22-20-11-5-4-10-18(20)16-19(25(22)21-12-6-7-14-24(21)28)13-15-29-23(27)17-8-2-1-3-9-17/h1-12,14,16H,13,15H2
InChIKey SNDUWQZVFCMTNK-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI
Literature Reference DOI 10.1002/chem.201601101
Molecular Weight 386.407 g/mol
Quality 61
Reported Formula C23H18N2O4
SMILES C1(N2C(=CC=3C(C2=O)=CC=CC3)CCOC(C2=CC=CC=C2)=O)=CC=CC=[N+]1[O-]
SPLASH splash10-001j-0390000000-9efdc2c18ea78838b15a
Source of Spectrum QE-22-SM12-3bi (DOI: 10.1002/chem.201601101)
Wiley ID 1903301