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1,2-Bis(3,5-di-tert-butylphenyl)ethyne

View entire compound with spectra: 1 MS (GC)

1,2-Bis(3,5-di-tert-butylphenyl)ethyne
SpectraBase Compound ID ImmHTb2COAo
InChI InChI=1S/C30H42/c1-27(2,3)23-15-21(16-24(19-23)28(4,5)6)13-14-22-17-25(29(7,8)9)20-26(18-22)30(10,11)12/h15-20H,1-12H3
InChIKey WKFHWIOCXXJMLS-UHFFFAOYSA-N
Mol Weight 402.7 g/mol
Molecular Formula C30H42
Exact Mass 402.328651 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GDArjrFRprt
Name 1,2-Bis(3,5-di-tert-butylphenyl)ethyne
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H42
InChI InChI=1S/C30H42/c1-27(2,3)23-15-21(16-24(19-23)28(4,5)6)13-14-22-17-25(29(7,8)9)20-26(18-22)30(10,11)12/h15-20H,1-12H3
InChIKey WKFHWIOCXXJMLS-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol201244s
Molecular Weight 402.666 g/mol
SMILES c1(cc(cc(C(C)(C)C)c1)C(C)(C)C)C#Cc1cc(cc(C(C)(C)C)c1)C(C)(C)C
SPLASH splash10-0k9i-5107900000-21e002d90c21989e343f
Source of Spectrum A1-13-3278/SMS6-2g
Wiley ID 1753418