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3-Oxo-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxylic acid
SpectraBase Compound ID 633RgWM2fho
InChI InChI=1S/C10H11NO3/c12-9-8(10(13)14)7-4-2-1-3-6(7)5-11-9/h5H,1-4H2,(H,11,12)(H,13,14)
InChIKey LYPCWRRGOYPJLZ-UHFFFAOYSA-N
Mol Weight 193.2 g/mol
Molecular Formula C10H11NO3
Exact Mass 193.073893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8vtUJW8Z2Zp
Name 3-Oxo-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxylic acid
Alternate Name(s) 4-Isoquinolinecarboxylic acid, 2,3,5,6,7,8-hexahydro-3-oxo- 3-Oxo-5,6,7,8-tetrahydro-2H-isoquinoline-4-carboxylic acid 3-Oxidanylidene-5,6,7,8-tetrahydro-2H-isoquinoline-4-carboxylic acid
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Formula C10H11NO3
InChI InChI=1S/C10H11NO3/c12-9-8(10(13)14)7-4-2-1-3-6(7)5-11-9/h5H,1-4H2,(H,11,12)(H,13,14)
InChIKey LYPCWRRGOYPJLZ-UHFFFAOYSA-N
Molecular Weight 193.202 g/mol
SMILES N1C=C2C(=C(C(=O)O)C1=O)CCCC2
SPLASH splash10-0005-9800000000-e137ac367e1748eddf45
Source of Spectrum IY-2-4931-8
Wiley ID 1657301