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2-[1,1'-Biphenyl]-4-yl-2-oxoethyl octanoate

View entire compound with spectra: 4 MS (GC)

2-[1,1'-Biphenyl]-4-yl-2-oxoethyl octanoate
SpectraBase Compound ID GjHDhD9L3vV
InChI InChI=1S/C22H26O3/c1-2-3-4-5-9-12-22(24)25-17-21(23)20-15-13-19(14-16-20)18-10-7-6-8-11-18/h6-8,10-11,13-16H,2-5,9,12,17H2,1H3
InChIKey VEJHBNSTZDNKOS-UHFFFAOYSA-N
Mol Weight 338.45 g/mol
Molecular Formula C22H26O3
Exact Mass 338.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IM31DQx0rui
Name OCTANOIC ACID, 2-[1,1'-BIPHENYL]-4-YL-2-OXOETHYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C22H26O3
InChI InChI=1S/C22H26O3/c1-2-3-4-5-9-12-22(24)25-17-21(23)20-15-13-19(14-16-20)18-10-7-6-8-11-18/h6-8,10-11,13-16H,2-5,9,12,17H2,1H3
InChIKey VEJHBNSTZDNKOS-UHFFFAOYSA-N
Molecular Weight 338.1875
SMILES c1ccc(-c2ccc(C(COC(CCCCCCC)=O)=O)cc2)cc1
SPLASH splash10-001i-3900000000-11166c50b996453b2394
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany