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1-Oxo-2-(p-chlorophenyl)-3-(3'-chlorophenyl)-1,2,3,4-tetrahydroisoquinoline-4-carboxylic Acid
SpectraBase Compound ID AnKFaMkJBg5
InChI InChI=1S/C22H15Cl2NO3/c23-14-8-10-16(11-9-14)25-20(13-4-3-5-15(24)12-13)19(22(27)28)17-6-1-2-7-18(17)21(25)26/h1-12,19-20H,(H,27,28)
InChIKey LMOZHVFBKDAZRO-UHFFFAOYSA-N
Mol Weight 412.27 g/mol
Molecular Formula C22H15Cl2NO3
Exact Mass 411.042899 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GAYCcHwJErN
Name 1-Oxo-2-(p-chlorophenyl)-3-(3'-chlorophenyl)-1,2,3,4-tetrahydroisoquinoline-4-carboxylic Acid
Alternate Name(s) 3-(3-Chlorophenyl)-2-(4-chlorophenyl)-1-oxo-1,2,3,4-tetrahydro-4-isoquinolinecarboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H15Cl2NO3
InChI InChI=1S/C22H15Cl2NO3/c23-14-8-10-16(11-9-14)25-20(13-4-3-5-15(24)12-13)19(22(27)28)17-6-1-2-7-18(17)21(25)26/h1-12,19-20H,(H,27,28)
InChIKey LMOZHVFBKDAZRO-UHFFFAOYSA-N
Molecular Weight 412.272 g/mol
SMILES OC(C1C(N(C(c2ccccc12)=O)c1ccc(cc1)Cl)c1cc(Cl)ccc1)=O
SPLASH splash10-0170-9863100000-11ada7cfd9dcfeb16de0
Source of Spectrum AJ-43-189-4
Wiley ID 1593836