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Di-tert-butylpentaphene
SpectraBase Compound ID 5EImzoKtPUb
InChI InChI=1S/C30H30/c1-29(2,3)25-11-9-19-17-27-21(13-23(19)15-25)7-8-22-14-24-16-26(30(4,5)6)12-10-20(24)18-28(22)27/h7-18H,1-6H3
InChIKey CQIKKIMXUQTVIX-UHFFFAOYSA-N
Mol Weight 390.57 g/mol
Molecular Formula C30H30
Exact Mass 390.234751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HdfaccLpsGx
Name Di-tert-butylpentaphene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H30
InChI InChI=1S/C30H30/c1-29(2,3)25-11-9-19-17-27-21(13-23(19)15-25)7-8-22-14-24-16-26(30(4,5)6)12-10-20(24)18-28(22)27/h7-18H,1-6H3
InChIKey CQIKKIMXUQTVIX-UHFFFAOYSA-N
Literature Reference DOI 10.1002/anie.201201374
Molecular Weight 390.570 g/mol
SMILES c1cc(C(C)(C)C)cc2cc3c(cc12)c1c(cc2c(c1)ccc(c2)C(C)(C)C)cc3
SPLASH splash10-0006-0109000000-5463619a752c2d8960a6
Source of Spectrum ACI-51-SM32-8
Synonyms 3,10-di-tert-butylpentaphene
Wiley ID 1780292