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1-Oxo-1,2-dihydroisoquinolin-4-yl acetate
SpectraBase Compound ID 1xtVzAYAPCs
InChI InChI=1S/C11H9NO3/c1-7(13)15-10-6-12-11(14)9-5-3-2-4-8(9)10/h2-6H,1H3,(H,12,14)
InChIKey RJJOXIPQXMTWPB-UHFFFAOYSA-N
Mol Weight 203.2 g/mol
Molecular Formula C11H9NO3
Exact Mass 203.058243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5UoMW124Geu
Name 1-Oxo-1,2-dihydroisoquinolin-4-yl acetate
Appearance Pale pink solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 203.058243151 u
Formula C11H9NO3
InChI InChI=1S/C11H9NO3/c1-7(13)15-10-6-12-11(14)9-5-3-2-4-8(9)10/h2-6H,1H3,(H,12,14)
InChIKey RJJOXIPQXMTWPB-UHFFFAOYSA-N
Instrument Name Finnigan MAT 8200
Ionization Type EI
Literature Reference DOI 10.1002/chem.201500173
Molecular Weight 203.197 g/mol
Quality 299
Reported Formula C11H9O3N
SMILES N1C=C(C2=C(C1=O)C=CC=C2)OC(C)=O
SPLASH splash10-001d-9000000000-2588d1238366393dc225
Source of Spectrum QE-21-SM20-S6 (DOI: 10.1002/chem.201500173)
Thin-Layer Chromatography 0.49 (EtOAc)
Wiley ID 1906450