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3-Isoquinolinecarboxylic acid, 1,2-dihydro-, ethyl ester
SpectraBase Compound ID rt142HA2IP
InChI InChI=1S/C12H13NO2/c1-2-15-12(14)11-7-9-5-3-4-6-10(9)8-13-11/h3-7,13H,2,8H2,1H3
InChIKey XXVUIHBGWMJZAG-UHFFFAOYSA-N
Mol Weight 203.24 g/mol
Molecular Formula C12H13NO2
Exact Mass 203.094629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 11BF0KSyUoI
Name 3-Isoquinolinecarboxylic acid, 1,2-dihydro-, ethyl ester
CAS Registry Number 95377-50-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13NO2
InChI InChI=1S/C12H13NO2/c1-2-15-12(14)11-7-9-5-3-4-6-10(9)8-13-11/h3-7,13H,2,8H2,1H3
InChIKey XXVUIHBGWMJZAG-UHFFFAOYSA-N
Molecular Weight 203.241 g/mol
SMILES N1Cc2ccccc2C=C1C(=O)OCC
SPLASH splash10-0ue9-0980000000-5386d2ac87226ce59425
Source of Spectrum J-51-1123-9
Synonyms 1,2-Dihydroisoquinoline-3-carboxylic acid ethyl ester Ethyl 1,2-dihydro-3-isoquinolinecarboxylate Ethyl 1,2-dihydroisoquinoline-3-carboxylate
Wiley ID 1200879