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N-[2-(3,4-Dimethoxyphenyl)ethyl]-6-phenyl-4-oxohex-5-ynamide
SpectraBase Compound ID JGKJwCBiARS
InChI InChI=1S/C22H23NO4/c1-26-20-12-9-18(16-21(20)27-2)14-15-23-22(25)13-11-19(24)10-8-17-6-4-3-5-7-17/h3-7,9,12,16H,11,13-15H2,1-2H3,(H,23,25)
InChIKey DMZRDIZCVHHERH-UHFFFAOYSA-N
Mol Weight 365.43 g/mol
Molecular Formula C22H23NO4
Exact Mass 365.162708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 72LSRpbHFA9
Name N-[2-(3,4-Dimethoxyphenyl)ethyl]-6-phenyl-4-oxohex-5-ynamide
Alternate Name(s) N-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-6-phenyl-5-hexynamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H23NO4
InChI InChI=1S/C22H23NO4/c1-26-20-12-9-18(16-21(20)27-2)14-15-23-22(25)13-11-19(24)10-8-17-6-4-3-5-7-17/h3-7,9,12,16H,11,13-15H2,1-2H3,(H,23,25)
InChIKey DMZRDIZCVHHERH-UHFFFAOYSA-N
Molecular Weight 365.429 g/mol
SMILES N(C(CCC(C#Cc1ccccc1)=O)=O)CCc1cc(OC)c(cc1)OC
SPLASH splash10-03di-1900000000-ae463e92130592972fbb
Source of Spectrum J-62-2087-6
Wiley ID 1351481