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2-methyl-4-(2-((2,4,5-trimethylphenyl)ethynyl)phenyl)but-3-yn-2-yl acetate
SpectraBase Compound ID ErhkwMSgMT8
InChI InChI=1S/C24H24O2/c1-17-15-19(3)23(16-18(17)2)12-11-21-9-7-8-10-22(21)13-14-24(5,6)26-20(4)25/h7-10,15-16H,1-6H3
InChIKey LTIJYLBXTNAKES-UHFFFAOYSA-N
Mol Weight 344.45 g/mol
Molecular Formula C24H24O2
Exact Mass 344.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A77zkHkCWj5
Name 2-methyl-4-(2-((2,4,5-trimethylphenyl)ethynyl)phenyl)but-3-yn-2-yl acetate
Appearance Light yellow oil
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Exact Mass 344.177630011 u
Formula C24H24O2
InChI InChI=1S/C24H24O2/c1-17-15-19(3)23(16-18(17)2)12-11-21-9-7-8-10-22(21)13-14-24(5,6)26-20(4)25/h7-10,15-16H,1-6H3
InChIKey LTIJYLBXTNAKES-UHFFFAOYSA-N
Instrument Name JEOL JMD-700
Ionization Type EI positive ion
Literature Reference DOI 10.1002/chem.201501725
Molecular Weight 344.454 g/mol
Reported Formula C24H24O2
SMILES C1=C(C(=CC=C1)C#CC1=CC(=C(C=C1C)C)C)C#CC(OC(C)=O)(C)C
SPLASH splash10-0f89-0090000000-f7d56cfab55ce8b14116
Source of Spectrum QE-21-SM45-1f (DOI: 10.1002/chem.201501725)
Thin-Layer Chromatography 0.65 (PE/EA, 5:1)
Wiley ID 1907064