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4-Ethyl-5-nitro-2,6-bis(p-tolyl)cyclohexane-1,1,3,3-tetracarbonitrile
SpectraBase Compound ID BT1thjasgSM
InChI InChI=1S/C26H23N5O2/c1-4-21-23(31(32)33)22(19-9-5-17(2)6-10-19)26(15-29,16-30)24(25(21,13-27)14-28)20-11-7-18(3)8-12-20/h5-12,21-24H,4H2,1-3H3
InChIKey PEXGHSXRESTZCV-UHFFFAOYSA-N
Mol Weight 437.5 g/mol
Molecular Formula C26H23N5O2
Exact Mass 437.185175 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GYLqctsTd5Q
Name 4-Ethyl-5-nitro-2,6-bis(p-tolyl)cyclohexane-1,1,3,3-tetracarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H23N5O2
InChI InChI=1S/C26H23N5O2/c1-4-21-23(31(32)33)22(19-9-5-17(2)6-10-19)26(15-29,16-30)24(25(21,13-27)14-28)20-11-7-18(3)8-12-20/h5-12,21-24H,4H2,1-3H3
InChIKey PEXGHSXRESTZCV-UHFFFAOYSA-N
Molecular Weight 437.503 g/mol
SMILES C1(C(C(N(=O)=O)C(C(C1c1ccc(cc1)C)(C#N)C#N)CC)c1ccc(cc1)C)(C#N)C#N
SPLASH splash10-014l-0900000000-6da57a98c308ea31d5b4
Source of Spectrum U1-2008-6172-3f
Wiley ID 1662336