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[3,4-Bis(m-tolylethynyl)phenyl]phenylmethanone
SpectraBase Compound ID Ftdb8E1ZAvo
InChI InChI=1S/C31H22O/c1-23-8-6-10-25(20-23)14-16-27-18-19-30(31(32)28-12-4-3-5-13-28)22-29(27)17-15-26-11-7-9-24(2)21-26/h3-13,18-22H,1-2H3
InChIKey OIYSUMSYOGRXJP-UHFFFAOYSA-N
Mol Weight 410.52 g/mol
Molecular Formula C31H22O
Exact Mass 410.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J1kVLuWGbdf
Name [3,4-Bis(m-tolylethynyl)phenyl]phenylmethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H22O
InChI InChI=1S/C31H22O/c1-23-8-6-10-25(20-23)14-16-27-18-19-30(31(32)28-12-4-3-5-13-28)22-29(27)17-15-26-11-7-9-24(2)21-26/h3-13,18-22H,1-2H3
InChIKey OIYSUMSYOGRXJP-UHFFFAOYSA-N
Molecular Weight 410.516 g/mol
SMILES C(#Cc1cc(C)ccc1)c1cc(C(=O)c2ccccc2)ccc1C#Cc1cc(C)ccc1
SPLASH splash10-03di-0021900000-e72141d07bcb3953e8a5
Source of Spectrum F4-44-228-6f
Wiley ID 1706774