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3,5-Bis[.beta.-(4-acetoxy-3-methoxyphenyl)ethyl]pyrazole
SpectraBase Compound ID DMgMYdpCMZ
InChI InChI=1S/C25H28N2O6/c1-16(28)32-22-11-7-18(13-24(22)30-3)5-9-20-15-21(27-26-20)10-6-19-8-12-23(33-17(2)29)25(14-19)31-4/h7-8,11-15H,5-6,9-10H2,1-4H3,(H,26,27)
InChIKey UJJIEANPKJVQJN-UHFFFAOYSA-N
Mol Weight 452.51 g/mol
Molecular Formula C25H28N2O6
Exact Mass 452.194737 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1WbZeSIhJ4I
Name 3,5-Bis[.beta.-(4-acetoxy-3-methoxyphenyl)ethyl]pyrazole
Alternate Name(s) 4-[2-(3-{2-[4-(acetyloxy)-3-methoxyphenyl]ethyl}-1H-pyrazol-5-yl)ethyl]-2-methoxyphenyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H28N2O6
InChI InChI=1S/C25H28N2O6/c1-16(28)32-22-11-7-18(13-24(22)30-3)5-9-20-15-21(27-26-20)10-6-19-8-12-23(33-17(2)29)25(14-19)31-4/h7-8,11-15H,5-6,9-10H2,1-4H3,(H,26,27)
InChIKey UJJIEANPKJVQJN-UHFFFAOYSA-N
Molecular Weight 452.507 g/mol
SMILES [nH]1c(cc(n1)CCc1cc(c(cc1)OC(=O)C)OC)CCc1cc(c(cc1)OC(=O)C)OC
SPLASH splash10-03y0-0654900000-afea261001c622c6807c
Source of Spectrum O1-65-55-7
Wiley ID 1592987