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5-(3-Butonyl)-4-cyano-1-methyl-3-methoxy-5,6-dihydroisoquinoline
SpectraBase Compound ID J7T6Umr5MQ4
InChI InChI=1S/C16H18N2O2/c1-10(19)7-8-12-5-4-6-13-11(2)18-16(20-3)14(9-17)15(12)13/h4,6,12H,5,7-8H2,1-3H3
InChIKey DGUIEJYGEHXHJH-UHFFFAOYSA-N
Mol Weight 270.33 g/mol
Molecular Formula C16H18N2O2
Exact Mass 270.136828 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8ieMUQdl7NJ
Name 5-(3-Butonyl)-4-cyano-1-methyl-3-methoxy-5,6-dihydroisoquinoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18N2O2
InChI InChI=1S/C16H18N2O2/c1-10(19)7-8-12-5-4-6-13-11(2)18-16(20-3)14(9-17)15(12)13/h4,6,12H,5,7-8H2,1-3H3
InChIKey DGUIEJYGEHXHJH-UHFFFAOYSA-N
Molecular Weight 270.332 g/mol
SMILES c1(c(nc(c2c1C(CCC(=O)C)CC=C2)C)OC)C#N
SPLASH splash10-0008-5930000000-617efff9a89d61f67a1e
Source of Spectrum Y1-35-469-1
Synonyms 3-Methoxy-1-methyl-5-(3-oxobutyl)-5,6-dihydro-4-isoquinolinecarbonitrile
Wiley ID 1526720