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6-Amino-2-methyl-8-(4-nitrophenyl)-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
SpectraBase Compound ID F3ZrjzBgeHh
InChI InChI=1S/C19H16N6O2/c1-24-7-6-14-15(8-20)18(23)19(10-21,11-22)17(16(14)9-24)12-2-4-13(5-3-12)25(26)27/h2-6,16-17H,7,9,23H2,1H3
InChIKey JNUYOQQSJNOBBN-UHFFFAOYSA-N
Mol Weight 360.38 g/mol
Molecular Formula C19H16N6O2
Exact Mass 360.133474 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1KetupTDRw
Name 6-Amino-2-methyl-8-(4-nitrophenyl)-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H16N6O2
InChI InChI=1S/C19H16N6O2/c1-24-7-6-14-15(8-20)18(23)19(10-21,11-22)17(16(14)9-24)12-2-4-13(5-3-12)25(26)27/h2-6,16-17H,7,9,23H2,1H3
InChIKey JNUYOQQSJNOBBN-UHFFFAOYSA-N
Literature Reference DOI 10.1016/j.tet.2016.02.023
Molecular Weight 360.377 g/mol
SMILES NC1=C(C2=CCN(CC2C(C1(C#N)C#N)c1ccc(cc1)[N+]([O-])=O)C)C#N
SPLASH splash10-01qi-0619000000-6172f9e46294f811f08d
Source of Spectrum F-72-1702-5e
Wiley ID 1805883