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9-(1,2,2-Tricyanoethenyl)-.alpha.-tocopher-6-one

View entire compound with spectra: 1 MS (GC)

9-(1,2,2-Tricyanoethenyl)-.alpha.-tocopher-6-one
SpectraBase Compound ID GTTRzYJuW09
InChI InChI=1S/C34H49N3O2/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-33(5)22-20-30-27(3)32(38)26(2)28(4)34(30,39-33)31(25-37)29(23-35)24-36/h6-22H2,1-5H3
InChIKey HLFOVSDNJQNZGS-UHFFFAOYSA-N
Mol Weight 531.8 g/mol
Molecular Formula C34H49N3O2
Exact Mass 531.382478 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LIk4rudoBap
Name 9-(1,2,2-Tricyanoethenyl)-.alpha.-tocopher-6-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H49N3O2
InChI InChI=1S/C34H49N3O2/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-33(5)22-20-30-27(3)32(38)26(2)28(4)34(30,39-33)31(25-37)29(23-35)24-36/h6-22H2,1-5H3
InChIKey HLFOVSDNJQNZGS-UHFFFAOYSA-N
Molecular Weight 531.785 g/mol
SMILES C12(C(=C(C)C(C(=C2C)C)=O)CCC(O1)(CCCCCCCCCCCCCCCC)C)C(=C(C#N)C#N)C#N
SPLASH splash10-00di-9001000000-aaa03e77df00e925934f
Source of Spectrum Y1-35-649-5
Wiley ID 1526792