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4,6-Di(6-methyl-4-(4-methylphenyl)-1,2,3,4-tetrahydro-1-naphthyl)-1,3-benzenedicarbonitrile
SpectraBase Compound ID 6SBDGx5W2kO
InChI InChI=1S/C44H40N2/c1-27-5-11-31(12-6-27)35-17-19-37(39-15-9-29(3)21-43(35)39)41-24-42(34(26-46)23-33(41)25-45)38-20-18-36(32-13-7-28(2)8-14-32)44-22-30(4)10-16-40(38)44/h5-16,21-24,35-38H,17-20H2,1-4H3
InChIKey HCZAHEIRKCKYOJ-UHFFFAOYSA-N
Mol Weight 596.8 g/mol
Molecular Formula C44H40N2
Exact Mass 596.319149 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 62wZRW8pQK2
Name 4,6-Di(6-methyl-4-(4-methylphenyl)-1,2,3,4-tetrahydro-1-naphthyl)-1,3-benzenedicarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C44H40N2
InChI InChI=1S/C44H40N2/c1-27-5-11-31(12-6-27)35-17-19-37(39-15-9-29(3)21-43(35)39)41-24-42(34(26-46)23-33(41)25-45)38-20-18-36(32-13-7-28(2)8-14-32)44-22-30(4)10-16-40(38)44/h5-16,21-24,35-38H,17-20H2,1-4H3
InChIKey HCZAHEIRKCKYOJ-UHFFFAOYSA-N
Molecular Weight 596.818 g/mol
SMILES c1(cc(c(cc1C1CCC(c2cc(ccc12)C)c1ccc(cc1)C)C1CCC(c2cc(ccc12)C)c1ccc(cc1)C)C#N)C#N
SPLASH splash10-0a4i-0290030000-e630f5c7a7223666b8cb
Source of Spectrum F-62-5671-13
Synonyms 4,6-bis[6-methyl-4-(4-methylphenyl)-1,2,3,4-tetrahydro-1-naphthalenyl]isophthalonitrile
Wiley ID 1633499