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(3S,4S)-2-methyl-3-phenyl-4-prop-2-enyl-3,4-dihydroisoquinolin-1-one
SpectraBase Compound ID 1PaKE4BAvsG
InChI InChI=1S/C19H19NO/c1-3-9-16-15-12-7-8-13-17(15)19(21)20(2)18(16)14-10-5-4-6-11-14/h3-8,10-13,16,18H,1,9H2,2H3/t16-,18+/m0/s1
InChIKey YISHPOUGMQKFGE-FUHWJXTLSA-N
Mol Weight 277.37 g/mol
Molecular Formula C19H19NO
Exact Mass 277.146664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G1P9jvsQ2yB
Name (3S,4S)-2-methyl-3-phenyl-4-prop-2-enyl-3,4-dihydroisoquinolin-1-one
Alternate Name(s) (3S,4S)-4-allyl-2-methyl-3-phenyl-3,4-dihydroisocarbostyril (3S,4S)-4-allyl-2-methyl-3-phenyl-3,4-dihydroisoquinolin-1-one
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Formula C19H19NO
InChI InChI=1S/C19H19NO/c1-3-9-16-15-12-7-8-13-17(15)19(21)20(2)18(16)14-10-5-4-6-11-14/h3-8,10-13,16,18H,1,9H2,2H3/t16-,18+/m0/s1
InChIKey YISHPOUGMQKFGE-FUHWJXTLSA-N
Molecular Weight 277.367 g/mol
SMILES C1(N([C@@]([C@](c2ccccc12)(CC=C)[H])(c1ccccc1)[H])C)=O
SPLASH splash10-05pa-0940000000-02c46ca7a2a3297815a6
Source of Spectrum J-66-1997-9
Wiley ID 1534852