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

*Links on SpectraBase are not permalinks.
Isoquinoline, 4-[(3,4-dimethoxyphenyl)methyl]-1,2,3,4-tetrahydro-6,7-dimethoxy-2-(t rifluoroacetyl)-
SpectraBase Compound ID AMvZeG8JIgZ
InChI InChI=1S/C22H24F3NO5/c1-28-17-6-5-13(8-18(17)29-2)7-14-11-26(21(27)22(23,24)25)12-15-9-19(30-3)20(31-4)10-16(14)15/h5-6,8-10,14H,7,11-12H2,1-4H3
InChIKey JAVUKNAHPWYMDJ-UHFFFAOYSA-N
Mol Weight 439.43 g/mol
Molecular Formula C22H24F3NO5
Exact Mass 439.160657 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 KGsqTiz29Vf
Name Isoquinoline, 4-[(3,4-dimethoxyphenyl)methyl]-1,2,3,4-tetrahydro-6,7-dimethoxy-2-(t rifluoroacetyl)-
Alternate Name(s) 1,2,3,4-Tetrahydro-6,7-dimethoxy-4-(3,4-dimethoxybenzyl)-2-trifluoroacetyliso-quinoline 4-(3,4-dimethoxybenzyl)-6,7-dimethoxy-2-(trifluoroacetyl)-1,2,3,4-tetrahydroisoquinoline
CAS Registry Number 87879-99-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H24F3NO5
InChI InChI=1S/C22H24F3NO5/c1-28-17-6-5-13(8-18(17)29-2)7-14-11-26(21(27)22(23,24)25)12-15-9-19(30-3)20(31-4)10-16(14)15/h5-6,8-10,14H,7,11-12H2,1-4H3
InChIKey JAVUKNAHPWYMDJ-UHFFFAOYSA-N
Molecular Weight 439.431 g/mol
SMILES C(N1Cc2cc(OC)c(cc2C(C1)Cc1cc(OC)c(cc1)OC)OC)(C(F)(F)F)=O
SPLASH splash10-0udr-0930200000-7c28c2b327a5ec887915
Source of Spectrum KC-1983-2056-0
Wiley ID 1384401