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6H-Azocino[2,1-a]isoquinoline-9-carboxylic acid, 5,8,9,10,11,12-hexahydro-2,3-dimethoxy-8-oxo-
SpectraBase Compound ID LMC8ubPFre
InChI InChI=1S/C18H21NO5/c1-23-15-9-11-7-8-19-14(13(11)10-16(15)24-2)6-4-3-5-12(17(19)20)18(21)22/h6,9-10,12H,3-5,7-8H2,1-2H3,(H,21,22)/b14-6-
InChIKey JAXLAJUCCGOTKU-NSIKDUERSA-N
Mol Weight 331.37 g/mol
Molecular Formula C18H21NO5
Exact Mass 331.141973 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2UFKEBivVSe
Name 6H-Azocino[2,1-a]isoquinoline-9-carboxylic acid, 5,8,9,10,11,12-hexahydro-2,3-dimethoxy-8-oxo-
CAS Registry Number 78631-84-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21NO5
InChI InChI=1S/C18H21NO5/c1-23-15-9-11-7-8-19-14(13(11)10-16(15)24-2)6-4-3-5-12(17(19)20)18(21)22/h6,9-10,12H,3-5,7-8H2,1-2H3,(H,21,22)/b14-6-
InChIKey JAXLAJUCCGOTKU-NSIKDUERSA-N
Molecular Weight 331.368 g/mol
SMILES OC(C1C(N2\C(c3cc(OC)c(cc3CC2)OC)=C\CCC1)=O)=O
SPLASH splash10-052r-0090000000-b42bfe2f152ddf5f5dce
Source of Spectrum K-114-2174-0
Synonyms 2,3-Dimethoxy-8-oxo-5,8,9,10,11,12-hexahydro-6H-azocino[2,1-a]isoquinoline-9-carboxylic acid 5,8,9,10,11,12-Hexahydro-2,3-dimethoxy-8-oxo-6H-azocino[2,1-a]isoquinolin-9-carboxylic acid
Wiley ID 1328690