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7,7-Bis(p-tert-butylphenyl)-7-phenyl-1-iodoheptane
SpectraBase Compound ID 9TK49fpkQEl
InChI InChI=1S/C33H43I/c1-31(2,3)26-16-20-29(21-17-26)33(24-12-7-8-13-25-34,28-14-10-9-11-15-28)30-22-18-27(19-23-30)32(4,5)6/h9-11,14-23H,7-8,12-13,24-25H2,1-6H3
InChIKey SKCHWPVHPREAOQ-UHFFFAOYSA-N
Mol Weight 566.6 g/mol
Molecular Formula C33H43I
Exact Mass 566.240946 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Z5nvAS868m
Name 7,7-Bis(p-tert-butylphenyl)-7-phenyl-1-iodoheptane
Alternate Name(s) 1-tert-Butyl-4-[1-(4-tert-butylphenyl)-7-iodo-1-phenylheptyl]benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H43I
InChI InChI=1S/C33H43I/c1-31(2,3)26-16-20-29(21-17-26)33(24-12-7-8-13-25-34,28-14-10-9-11-15-28)30-22-18-27(19-23-30)32(4,5)6/h9-11,14-23H,7-8,12-13,24-25H2,1-6H3
InChIKey SKCHWPVHPREAOQ-UHFFFAOYSA-N
Molecular Weight 566.611 g/mol
SMILES C(c1ccc(C(C)(C)C)cc1)(c1ccc(C(C)(C)C)cc1)(c1ccccc1)CCCCCCI
SPLASH splash10-0a4i-0319510000-ecafb5b8c9c0727d5025
Source of Spectrum J-58-3754-18
Wiley ID 1407343