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7,8-Dimethoxy-4-(phenylthio)-3,4-dihydro-1H-isoquinoline-2-carbaldehyde

View entire compound with spectra: 1 MS (GC)

7,8-Dimethoxy-4-(phenylthio)-3,4-dihydro-1H-isoquinoline-2-carbaldehyde
SpectraBase Compound ID Jz8xkRBbNrF
InChI InChI=1S/C18H19NO3S/c1-21-16-9-8-14-15(18(16)22-2)10-19(12-20)11-17(14)23-13-6-4-3-5-7-13/h3-9,12,17H,10-11H2,1-2H3
InChIKey BZBDVILOSMKRIU-UHFFFAOYSA-N
Mol Weight 329.41 g/mol
Molecular Formula C18H19NO3S
Exact Mass 329.108565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IwT2M5iGlLN
Name 7,8-Dimethoxy-4-(phenylthio)-3,4-dihydro-1H-isoquinoline-2-carbaldehyde
Alternate Name(s) 7,8-Dimethoxy-4-(phenylthio)-3,4-dihydro-1H-isoquinoline-2-carboxaldehyde 7,8-Dimethoxy-4-phenylsulfanyl-3,4-dihydro-1H-isoquinoline-2-carbaldehyde
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Formula C18H19NO3S
InChI InChI=1S/C18H19NO3S/c1-21-16-9-8-14-15(18(16)22-2)10-19(12-20)11-17(14)23-13-6-4-3-5-7-13/h3-9,12,17H,10-11H2,1-2H3
InChIKey BZBDVILOSMKRIU-UHFFFAOYSA-N
Molecular Weight 329.414 g/mol
SMILES C1N(CC(c2ccc(c(c12)OC)OC)Sc1ccccc1)C=O
SPLASH splash10-00di-0490000000-f9cf8a982d799177da66
Source of Spectrum E2-46-924-11
Wiley ID 1554466