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1-(6'-Butyl-2'-hydroxymethyl-4'-methoxymethyl-biphenyl-4-yl)-ethanone
SpectraBase Compound ID KcLk8daqFB4
InChI InChI=1S/C21H26O3/c1-4-5-6-19-11-16(14-24-3)12-20(13-22)21(19)18-9-7-17(8-10-18)15(2)23/h7-12,22H,4-6,13-14H2,1-3H3
InChIKey QMNYLMLTQSWTHV-UHFFFAOYSA-N
Mol Weight 326.44 g/mol
Molecular Formula C21H26O3
Exact Mass 326.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ZSPbReiPo
Name 1-(6'-Butyl-2'-hydroxymethyl-4'-methoxymethyl-biphenyl-4-yl)-ethanone
Alternate Name(s) 1-[2'-butyl-6'-(hydroxymethyl)-4'-(methoxymethyl)[1,1'-biphenyl]-4-yl]ethanone 4-Acetyl-2',4'-dibutyl-6'-hydroxymethylbiphenyl
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26O3
InChI InChI=1S/C21H26O3/c1-4-5-6-19-11-16(14-24-3)12-20(13-22)21(19)18-9-7-17(8-10-18)15(2)23/h7-12,22H,4-6,13-14H2,1-3H3
InChIKey QMNYLMLTQSWTHV-UHFFFAOYSA-N
Molecular Weight 326.436 g/mol
SMILES OCc1c(c(CCCC)cc(c1)COC)-c1ccc(cc1)C(=O)C
SPLASH splash10-00os-0097000000-ed54c5088bcc79432d06
Source of Spectrum KC-61-11507-9
Wiley ID 1631485