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1-(Phenylethynyl)-2-((2-(m-tolylethynyl)phenoxy)methyl)benzene
SpectraBase Compound ID 3S1AwJ3qX2J
InChI InChI=1S/C30H22O/c1-24-10-9-13-26(22-24)19-21-28-15-7-8-17-30(28)31-23-29-16-6-5-14-27(29)20-18-25-11-3-2-4-12-25/h2-17,22H,23H2,1H3
InChIKey VJFAWZNFDAJHEK-UHFFFAOYSA-N
Mol Weight 398.51 g/mol
Molecular Formula C30H22O
Exact Mass 398.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IN9Zbs37lfm
Name 1-(Phenylethynyl)-2-((2-(m-tolylethynyl)phenoxy)methyl)benzene
Appearance Orange solid
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Exact Mass 398.167065327 u
Formula C30H22O
InChI InChI=1S/C30H22O/c1-24-10-9-13-26(22-24)19-21-28-15-7-8-17-30(28)31-23-29-16-6-5-14-27(29)20-18-25-11-3-2-4-12-25/h2-17,22H,23H2,1H3
InChIKey VJFAWZNFDAJHEK-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202200984
Molecular Weight 398.505 g/mol
Quality 13
Reported Formula C30H22O
SMILES C1(=CC=CC=C1)C#CC1=C(C=CC=C1)COC1=C(C=CC=C1)C#CC1=CC(=CC=C1)C
SPLASH splash10-0006-0903000000-2fffe96bbaffb1d491b6
Source of Spectrum K1-2022-SM37-1c (DOI: 10.1002/ejoc.202200984)
Wiley ID 1898836