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4,4',4''-(Ethane-1,1,1-triyl)tris(2-allyl-1-(allyloxy)benzene)
SpectraBase Compound ID DLBRIUuISrO
InChI InChI=1S/C38H42O3/c1-8-14-29-26-32(17-20-35(29)39-23-11-4)38(7,33-18-21-36(40-24-12-5)30(27-33)15-9-2)34-19-22-37(41-25-13-6)31(28-34)16-10-3/h8-13,17-22,26-28H,1-6,14-16,23-25H2,7H3
InChIKey JKTYUXVRZJESJP-UHFFFAOYSA-N
Mol Weight 546.8 g/mol
Molecular Formula C38H42O3
Exact Mass 546.313395 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9uoDdJ5Q8Ji
Name 4,4',4''-(Ethane-1,1,1-triyl)tris(2-allyl-1-(allyloxy)benzene)
Appearance Pale yellow oil
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Formula C38H42O3
InChI InChI=1S/C38H42O3/c1-8-14-29-26-32(17-20-35(29)39-23-11-4)38(7,33-18-21-36(40-24-12-5)30(27-33)15-9-2)34-19-22-37(41-25-13-6)31(28-34)16-10-3/h8-13,17-22,26-28H,1-6,14-16,23-25H2,7H3
InChIKey JKTYUXVRZJESJP-UHFFFAOYSA-N
Instrument Name Finnigan TSQ 7000
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.10.180
Molecular Weight 546.751 g/mol
SMILES c1(cc(c(OCC=C)cc1)CC=C)C(c1cc(c(cc1)OCC=C)CC=C)(c1cc(c(cc1)OCC=C)CC=C)C
SPLASH splash10-001i-1000090000-50065778193b168c8f2f
Source of Spectrum BJO-10-SM9-12c
Wiley ID 1853941