For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
4,6-Bis[(4-tert-butylphenyl)ethynyl]-2,5-dichloropyrimidine
SpectraBase Compound ID 702QwEAisIF
InChI InChI=1S/C28H26Cl2N2/c1-27(2,3)21-13-7-19(8-14-21)11-17-23-25(29)24(32-26(30)31-23)18-12-20-9-15-22(16-10-20)28(4,5)6/h7-10,13-16H,1-6H3
InChIKey HOIZOIIGWRXNMQ-UHFFFAOYSA-N
Mol Weight 461.44 g/mol
Molecular Formula C28H26Cl2N2
Exact Mass 460.147304 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 1jLwcZ0VMvO
Name 4,6-Bis[(4-tert-butylphenyl)ethynyl]-2,5-dichloropyrimidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H26Cl2N2
InChI InChI=1S/C28H26Cl2N2/c1-27(2,3)21-13-7-19(8-14-21)11-17-23-25(29)24(32-26(30)31-23)18-12-20-9-15-22(16-10-20)28(4,5)6/h7-10,13-16H,1-6H3
InChIKey HOIZOIIGWRXNMQ-UHFFFAOYSA-N
Molecular Weight 461.436 g/mol
SMILES C(c1nc(Cl)nc(C#Cc2ccc(C(C)(C)C)cc2)c1Cl)#Cc1ccc(C(C)(C)C)cc1
SPLASH splash10-0002-0020900000-92e700b0c5b8d6fb2e51
Source of Spectrum U1-2011-2091-3a
Synonyms 4,6-bis[2-(4-tert-butylphenyl)ethynyl]-2,5-dichloropyrimidine 4,6-bis[2-(4-tert-butylphenyl)ethynyl]-2,5-bis(chloranyl)pyrimidine
Wiley ID 1665567