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

*Links on SpectraBase are not permalinks.
[2H2]-Dimethyl 2-Anilino-3-(isoquinolin-1-yl)succinate
SpectraBase Compound ID DtPITGtwwIw
InChI InChI=1S/C21H20N2O4/c1-26-20(24)17(18-16-11-7-6-8-14(16)12-13-22-18)19(21(25)27-2)23-15-9-4-3-5-10-15/h3-13,17,19,23H,1-2H3/i17D,19D
InChIKey BLVXUTDFIUCTBM-SWQBQBPGSA-N
Mol Weight 366.41 g/mol
Molecular Formula C21H182D2N2O4
Exact Mass 366.154861 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID Cbt31ZuWTS5
Name [2H2]-Dimethyl 2-Anilino-3-(isoquinolin-1-yl)succinate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H18D2N2O4
InChI InChI=1S/C21H20N2O4/c1-26-20(24)17(18-16-11-7-6-8-14(16)12-13-22-18)19(21(25)27-2)23-15-9-4-3-5-10-15/h3-13,17,19,23H,1-2H3/i17D,19D
InChIKey BLVXUTDFIUCTBM-SWQBQBPGSA-N
Literature Reference DOI 10.1002_1522-2675(20000906)83_9_2363
Molecular Weight 366.413 g/mol
SMILES N(C(C(c1c2c(cccc2)ccn1)(C(OC)=O)[2D])(C(OC)=O)[2D])c1ccccc1
SPLASH splash10-0udi-7940000000-d726ceb7c1c843eb68ad
Source of Spectrum H-83-2378-[2H2]_18
Synonyms Dimethyl 2-(isoquinolin-1-yl)-3-(phenylamino)succinate-d2
Wiley ID 1787525