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1-Isoquinolinehexanoic acid, 1,2,3,4-tetrahydro-6,7-dimethoxy-, methyl ester

View entire compound with spectra: 1 MS (GC)

1-Isoquinolinehexanoic acid, 1,2,3,4-tetrahydro-6,7-dimethoxy-, methyl ester
SpectraBase Compound ID JV7CnhAPomJ
InChI InChI=1S/C18H27NO4/c1-21-16-11-13-9-10-19-15(14(13)12-17(16)22-2)7-5-4-6-8-18(20)23-3/h11-12,15,19H,4-10H2,1-3H3
InChIKey ORJBDYUZHOTVDR-UHFFFAOYSA-N
Mol Weight 321.42 g/mol
Molecular Formula C18H27NO4
Exact Mass 321.194008 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EoPwZRxHor4
Name 1-Isoquinolinehexanoic acid, 1,2,3,4-tetrahydro-6,7-dimethoxy-, methyl ester
Alternate Name(s) Methyl 6-(6,7-dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)hexanoate Methyl ester of 6-[1,2,3,4-tetrahydro-6,7-dimethoxy isoquinolin-1-yl]hexanoic acid
CAS Registry Number 78632-04-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H27NO4
InChI InChI=1S/C18H27NO4/c1-21-16-11-13-9-10-19-15(14(13)12-17(16)22-2)7-5-4-6-8-18(20)23-3/h11-12,15,19H,4-10H2,1-3H3
InChIKey ORJBDYUZHOTVDR-UHFFFAOYSA-N
Molecular Weight 321.417 g/mol
SMILES N1CCc2cc(c(cc2C1CCCCCC(=O)OC)OC)OC
SPLASH splash10-0006-0910000000-4b8330a654c67fe87ad6
Source of Spectrum K-114-2178-0
Wiley ID 1320946