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7-HYDROXY-1-OXO-1,2-DIHYDROISOQUINOLINE-5-CARBOXYLIC_ACID
SpectraBase Compound ID AyTuwfmKTM3
InChI InChI=1S/C10H7NO4/c12-5-3-7-6(1-2-11-9(7)13)8(4-5)10(14)15/h1-4,12H,(H,11,13)(H,14,15)
InChIKey QBJOVHFWFSCZCX-UHFFFAOYSA-N
Mol Weight 205.17 g/mol
Molecular Formula C10H7NO4
Exact Mass 205.037508 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2xVvAnRkpWx
Name 7-HYDROXY-1-OXO-1,2-DIHYDROISOQUINOLINE-5-CARBOXYLIC_ACID
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H7NO4
InChI InChI=1S/C10H7NO4/c12-5-3-7-6(1-2-11-9(7)13)8(4-5)10(14)15/h1-4,12H,(H,11,13)(H,14,15)
InChIKey QBJOVHFWFSCZCX-UHFFFAOYSA-N
Literature Reference Author A.TEICHERT,J.SCHMIDT,A.PORZEL,N.ARNOLD,L.WESSJOHANN
Literature Reference Citation J.NAT.PROD.,71,1092(2008)
Literature Reference DOI 10.1021/np8000859
Molecular Weight 205.170 g/mol
Sample ID 28128
Solvent DMSO-D6