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2-Iodo-1,3,5-tri-tert-butylbenzene
SpectraBase Compound ID 5WtE5WdfnGV
InChI InChI=1S/C18H29I/c1-16(2,3)12-10-13(17(4,5)6)15(19)14(11-12)18(7,8)9/h10-11H,1-9H3
InChIKey NUTILFZRWFXEOL-UHFFFAOYSA-N
Mol Weight 372.33 g/mol
Molecular Formula C18H29I
Exact Mass 372.131396 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5cdBDUoLaam
Name 2-Iodo-1,3,5-tri-tert-butylbenzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H29I
InChI InChI=1S/C18H29I/c1-16(2,3)12-10-13(17(4,5)6)15(19)14(11-12)18(7,8)9/h10-11H,1-9H3
InChIKey NUTILFZRWFXEOL-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol800134g
Molecular Weight 372.334 g/mol
SMILES c1(c(c(C(C)(C)C)cc(C(C)(C)C)c1)I)C(C)(C)C
SPLASH splash10-0a4i-9011000000-8a2d8bd64f1412aa1397
Source of Spectrum A1-10-1227/SM5-19
Synonyms 1,3,5-tri-tert-butyl-2-iodobenzene 1,3,5-tritert-butyl-2-iodobenzene 1,3,5-tritert-butyl-2-iodanyl-benzene
Wiley ID 1759264