For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(TRANS)-N-(4'-CHLOROBENZYL)-1-OXO-3-(4''-TRIFLUOROMETHYLPHENYL)-1,2,3,4-TETRAHYDRO-ISOQUINOLINE-4-CARBOXYLIC-ACID
SpectraBase Compound ID FAVSu8LFo8k
InChI InChI=1S/C24H17ClF3NO3/c25-17-11-5-14(6-12-17)13-29-21(15-7-9-16(10-8-15)24(26,27)28)20(23(31)32)18-3-1-2-4-19(18)22(29)30/h1-12,20-21H,13H2,(H,31,32)/t20-,21+/m0/s1
InChIKey MQJRTEQQNSKRBB-LEWJYISDSA-N
Mol Weight 459.85 g/mol
Molecular Formula C24H17ClF3NO3
Exact Mass 459.084906 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID BNs4Y2cGFJD
Name (TRANS)-N-(4'-CHLOROBENZYL)-1-OXO-3-(4''-TRIFLUOROMETHYLPHENYL)-1,2,3,4-TETRAHYDRO-ISOQUINOLINE-4-CARBOXYLIC-ACID
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H17ClF3NO3
InChI InChI=1S/C24H17ClF3NO3/c25-17-11-5-14(6-12-17)13-29-21(15-7-9-16(10-8-15)24(26,27)28)20(23(31)32)18-3-1-2-4-19(18)22(29)30/h1-12,20-21H,13H2,(H,31,32)/t20-,21+/m0/s1
InChIKey MQJRTEQQNSKRBB-LEWJYISDSA-N
Literature Reference Author R.GITTO,E.FRANCICA,G.D.SARRO,F.SCICCHITANO,A.CHIMIRRI
Literature Reference Citation CHEM.PHARM.BULL.,56,181(2008)
Literature Reference DOI 10.1248/cpb.56.181
Molecular Weight 459.852 g/mol
Sample ID 1265
Solvent DMSO-D6