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Cyclohexanone, 2-[2-(1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-isoquinolinyl)ethyl]-
SpectraBase Compound ID b3r23oIrpT
InChI InChI=1S/C20H29NO3/c1-21-11-10-15-12-19(23-2)20(24-3)13-16(15)17(21)9-8-14-6-4-5-7-18(14)22/h12-14,17H,4-11H2,1-3H3
InChIKey IRMUUIKRERKZCH-UHFFFAOYSA-N
Mol Weight 331.46 g/mol
Molecular Formula C20H29NO3
Exact Mass 331.214744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BHNsNSbSuQr
Name Cyclohexanone, 2-[2-(1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-isoquinolinyl)ethyl]-
Alternate Name(s) 2-(2-(6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydro-1-isochinolinyl)ethyl)-cyclohexanone 2-[2-(6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydro-1-isoquinolinyl)ethyl]cyclohexanone
CAS Registry Number 63080-56-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H29NO3
InChI InChI=1S/C20H29NO3/c1-21-11-10-15-12-19(23-2)20(24-3)13-16(15)17(21)9-8-14-6-4-5-7-18(14)22/h12-14,17H,4-11H2,1-3H3
InChIKey IRMUUIKRERKZCH-UHFFFAOYSA-N
Molecular Weight 331.456 g/mol
SMILES c12C(N(C)CCc2cc(c(c1)OC)OC)CCC1C(=O)CCCC1
SPLASH splash10-0a4i-0590000000-489f7b762f5536ceb032
Source of Spectrum H-60-614-0
Wiley ID 1328817