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1,8-Bis(4-[(4-methylphenyl)ethynyl]phenyl)naphthalene
SpectraBase Compound ID 3gHbFfb4YfW
InChI InChI=1S/C40H28/c1-29-9-13-31(14-10-29)17-19-33-21-25-35(26-22-33)38-7-3-5-37-6-4-8-39(40(37)38)36-27-23-34(24-28-36)20-18-32-15-11-30(2)12-16-32/h3-16,21-28H,1-2H3
InChIKey UVOAPGCUODHHFI-UHFFFAOYSA-N
Mol Weight 508.7 g/mol
Molecular Formula C40H28
Exact Mass 508.219101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FMfRAs97fE0
Name 1,8-Bis(4-[(4-methylphenyl)ethynyl]phenyl)naphthalene
Alternate Name(s) 1,8-bis[4-[2-(4-methylphenyl)ethynyl]phenyl]naphthalene 1,8-bis[4-[2-(p-tolyl)ethynyl]phenyl]naphthalene Naphthalene, 1,8-bis[4-[(4-methylphenyl)ethynyl]phenyl]-
CAS Registry Number 124652-47-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C40H28
InChI InChI=1S/C40H28/c1-29-9-13-31(14-10-29)17-19-33-21-25-35(26-22-33)38-7-3-5-37-6-4-8-39(40(37)38)36-27-23-34(24-28-36)20-18-32-15-11-30(2)12-16-32/h3-16,21-28H,1-2H3
InChIKey UVOAPGCUODHHFI-UHFFFAOYSA-N
Molecular Weight 508.664 g/mol
SMILES c1cc(c2c(-c3ccc(cc3)C#Cc3ccc(cc3)C)cccc2c1)-c1ccc(cc1)C#Cc1ccc(cc1)C
SPLASH splash10-0a4i-0022590000-e498415c8bdf0d46f5f4
Wiley ID 1496495