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2'-Iodo-4,4"-bis(t-butyl)-2,2",6,6"-tetramethyl-1,1' ; 3',1"-terphenyl
SpectraBase Compound ID 1OETq1KHO4w
InChI InChI=1S/C30H37I/c1-18-14-22(29(5,6)7)15-19(2)26(18)24-12-11-13-25(28(24)31)27-20(3)16-23(17-21(27)4)30(8,9)10/h11-17H,1-10H3
InChIKey AYXASUUPOUIHLL-UHFFFAOYSA-N
Mol Weight 524.5 g/mol
Molecular Formula C30H37I
Exact Mass 524.193996 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Wj5vZ2bCar
Name 2'-Iodo-4,4"-bis(t-butyl)-2,2",6,6"-tetramethyl-1,1' ; 3',1"-terphenyl
Alternate Name(s) 1,3-bis(4-tert-butyl-2,6-dimethylphenyl)-2-iodobenzene
Comments Less than 3 mono-isotopic peaks
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Formula C30H37I
InChI InChI=1S/C30H37I/c1-18-14-22(29(5,6)7)15-19(2)26(18)24-12-11-13-25(28(24)31)27-20(3)16-23(17-21(27)4)30(8,9)10/h11-17H,1-10H3
InChIKey AYXASUUPOUIHLL-UHFFFAOYSA-N
Molecular Weight 524.530 g/mol
SMILES c1(c(c(-c2c(cc(cc2C)C(C)(C)C)C)ccc1)I)-c1c(cc(cc1C)C(C)(C)C)C
SPLASH splash10-0ab9-0000090000-55a102ed26ff1876dd02
Source of Spectrum G-69-1341-17
Wiley ID 1559677