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

*Links on SpectraBase are not permalinks.
acetamide, 2,2,2-trichloro-N-[(3,4-dihydro-6,7-dimethoxy-2(1H)-isoquinolinyl)carbonyl]-
SpectraBase Compound ID AHTyGXrPC1
InChI InChI=1S/C14H15Cl3N2O4/c1-22-10-5-8-3-4-19(7-9(8)6-11(10)23-2)13(21)18-12(20)14(15,16)17/h5-6H,3-4,7H2,1-2H3,(H,18,20,21)
InChIKey UEEINGLAALCHRY-UHFFFAOYSA-N
Mol Weight 381.64 g/mol
Molecular Formula C14H15Cl3N2O4
Exact Mass 380.00974 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 48llC9wky4U
Name Acetamide, 2,2,2-trichloro-N-[(3,4-dihydro-6,7-dimethoxy-2(1H)-isoquinolinyl)carbonyl]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 380.009740067 u
Formula C14H15Cl3N2O4
InChI InChI=1S/C14H15Cl3N2O4/c1-22-10-5-8-3-4-19(7-9(8)6-11(10)23-2)13(21)18-12(20)14(15,16)17/h5-6H,3-4,7H2,1-2H3,(H,18,20,21)
InChIKey UEEINGLAALCHRY-UHFFFAOYSA-N
Molecular Weight 381.643 g/mol
SMILES N(C(N1CC=2C=C(OC)C(=CC2CC1)OC)=O)C(C(Cl)(Cl)Cl)=O