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7-ACETYL-1,6-DIMETHYL-6-HYDROXY-8-PHENYL-4-CYANO-5,6,7,8-TETRAHYDRO-3-(2-H)-ISOQUINOLINE
SpectraBase Compound ID DIyIbJNEVyR
InChI InChI=1S/C20H20N2O3/c1-11-16-14(15(10-21)19(24)22-11)9-20(3,25)18(12(2)23)17(16)13-7-5-4-6-8-13/h4-8,17-18,25H,9H2,1-3H3,(H,22,24)
InChIKey MTUINQRIASFGRB-UHFFFAOYSA-N
Mol Weight 336.39 g/mol
Molecular Formula C20H20N2O3
Exact Mass 336.147393 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K4R1S1PYGYw
Name 7-Acetyl-6-hydroxy-1,6-dimethyl-3-oxo-8-phenyl-2,3,5,6,7,8-hexahydroisoquinoline-4-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20N2O3
InChI InChI=1S/C20H20N2O3/c1-11-16-14(15(10-21)19(24)22-11)9-20(3,25)18(12(2)23)17(16)13-7-5-4-6-8-13/h4-8,17-18,25H,9H2,1-3H3,(H,22,24)
InChIKey MTUINQRIASFGRB-UHFFFAOYSA-N
Literature Reference DOI 10.1007/s10593-015-1658-9
Molecular Weight 336.391 g/mol
SMILES N1C(C(=C2CC(C(C(C2=C1C)c1ccccc1)C(=O)C)(C)O)C#N)=O
SPLASH splash10-004l-8190000000-262b74b8b3fae712031a
Source of Spectrum HC-51-53-4a
Wiley ID 1803596