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2-BENZYL-7-CHLORO-4-OXO-1,2,3,4-TETRAHYDROISOQUINOLINECARBOXYLIC ACID, ETHYL ESTER, HYDROBROMIDE
SpectraBase Compound ID Hm1CbQd7r4m
InChI InChI=1S/C19H18ClNO3.BrH/c1-2-24-19(23)17-18(22)16-9-8-15(20)10-14(16)12-21(17)11-13-6-4-3-5-7-13;/h3-10,17H,2,11-12H2,1H3;1H
InChIKey QOHLPRUCWKTNMD-UHFFFAOYSA-N
Mol Weight 424.72 g/mol
Molecular Formula C19H19BrClNO3
Exact Mass 423.023684 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID DGDRdAmc272
Name 2-BENZYL-7-CHLORO-4-OXO-1,2,3,4-TETRAHYDROISOQUINOLINECARBOXYLIC ACID, ETHYL ESTER, HYDROBROMIDE
Source of Sample G. Grethe, Hoffmann-La Roche Inc., Nutley, New Jersey
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H19BrClNO3
InChI InChI=1S/C19H18ClNO3.BrH/c1-2-24-19(23)17-18(22)16-9-8-15(20)10-14(16)12-21(17)11-13-6-4-3-5-7-13;/h3-10,17H,2,11-12H2,1H3;1H
InChIKey QOHLPRUCWKTNMD-UHFFFAOYSA-N
Literature Reference JOCE 33, 494(1968)
Melting Point 146-151C (dec.)
Molecular Weight 424.725006
Synonyms 3-ISOQUINOLINECARBOXYLIC ACID, 2- BENZYL-7-CHLORO-4-OXO-1,2,3,4-TETRA- HYDRO-, ETHYL ESTER, HYDROBROMIDE
Technique KBr WAFER