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1-(5-tert-Butyl-2-ethynylphenylethynyl)pyrene

View entire compound with spectra: 1 MS (GC)

1-(5-tert-Butyl-2-ethynylphenylethynyl)pyrene
SpectraBase Compound ID 5BDmiQIHMdC
InChI InChI=1S/C30H22/c1-5-20-15-17-26(30(2,3)4)19-25(20)14-10-21-9-11-24-13-12-22-7-6-8-23-16-18-27(21)29(24)28(22)23/h1,6-9,11-13,15-19H,2-4H3
InChIKey QEJCQOLETHPBAG-UHFFFAOYSA-N
Mol Weight 382.51 g/mol
Molecular Formula C30H22
Exact Mass 382.172151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2GBWbhmpk0
Name 1-(5-tert-Butyl-2-ethynylphenylethynyl)pyrene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H22
InChI InChI=1S/C30H22/c1-5-20-15-17-26(30(2,3)4)19-25(20)14-10-21-9-11-24-13-12-22-7-6-8-23-16-18-27(21)29(24)28(22)23/h1,6-9,11-13,15-19H,2-4H3
InChIKey QEJCQOLETHPBAG-UHFFFAOYSA-N
Molecular Weight 382.506 g/mol
SMILES c12c3c(C#Cc4cc(C(C)(C)C)ccc4C#C)ccc1ccc1c2c(cc3)ccc1
SPLASH splash10-0089-0509000000-c5f0fd5c3a8dca47c0a3
Source of Spectrum J-73-2407-2
Wiley ID 1668046