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1-Methoxy-2-((2-((2-(phenylethynyl)benzyl)oxy)phenyl)ethynyl)benzene
SpectraBase Compound ID KgTxf270NbQ
InChI InChI=1S/C30H22O2/c1-31-29-17-9-7-14-26(29)21-22-27-15-8-10-18-30(27)32-23-28-16-6-5-13-25(28)20-19-24-11-3-2-4-12-24/h2-18H,23H2,1H3
InChIKey NHJSZZFPDUSZPJ-UHFFFAOYSA-N
Mol Weight 414.5 g/mol
Molecular Formula C30H22O2
Exact Mass 414.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1AXrPj3DZsm
Name 1-Methoxy-2-((2-((2-(phenylethynyl)benzyl)oxy)phenyl)ethynyl)benzene
Appearance Yellow solid
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Exact Mass 414.161979946 u
Formula C30H22O2
InChI InChI=1S/C30H22O2/c1-31-29-17-9-7-14-26(29)21-22-27-15-8-10-18-30(27)32-23-28-16-6-5-13-25(28)20-19-24-11-3-2-4-12-24/h2-18H,23H2,1H3
InChIKey NHJSZZFPDUSZPJ-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202200984
Molecular Weight 414.504 g/mol
Quality 25
Reported Formula C30H22O2
SMILES COC1=C(C=CC=C1)C#CC1=C(C=CC=C1)OCC1=C(C=CC=C1)C#CC1=CC=CC=C1
SPLASH splash10-0006-0901200000-728de865789404769c61
Source of Spectrum K1-2022-SM38-1e (DOI: 10.1002/ejoc.202200984)
Wiley ID 1898838