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2-Benzoyl-1-[2'-(2"-methyl-1",3"-dioxolan-2"-yl)benzyl]-1-cyano-1,2-dihydroisoquinoline
SpectraBase Compound ID LHJfaOXOKkQ
InChI InChI=1S/C28H24N2O3/c1-27(32-17-18-33-27)24-13-7-6-12-23(24)19-28(20-29)25-14-8-5-9-21(25)15-16-30(28)26(31)22-10-3-2-4-11-22/h2-16H,17-19H2,1H3
InChIKey RKZMEDANHNXAFS-UHFFFAOYSA-N
Mol Weight 436.51 g/mol
Molecular Formula C28H24N2O3
Exact Mass 436.178693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6p7tybaoOOq
Name 2-Benzoyl-1-[2'-(2"-methyl-1",3"-dioxolan-2"-yl)benzyl]-1-cyano-1,2-dihydroisoquinoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H24N2O3
InChI InChI=1S/C28H24N2O3/c1-27(32-17-18-33-27)24-13-7-6-12-23(24)19-28(20-29)25-14-8-5-9-21(25)15-16-30(28)26(31)22-10-3-2-4-11-22/h2-16H,17-19H2,1H3
InChIKey RKZMEDANHNXAFS-UHFFFAOYSA-N
Molecular Weight 436.511 g/mol
SMILES C1(N(C(=O)c2ccccc2)C=Cc2c1cccc2)(Cc1c(C2(OCCO2)C)cccc1)C#N
SPLASH splash10-0a4i-0900100000-bda1b8aba5426a6facfb
Source of Spectrum D8-326-256-5
Synonyms 2-Benzoyl-1-[2-(2-methyl-1,3-dioxolan-2-yl)benzyl]-1,2-dihydro-1-isoquinolinecarbonitrile
Wiley ID 1514731