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4-[2-(3-Oxobutyl)prop-2-en-1-yl]-3-(3,4,5-trimethoxyphenyl)-cyclohex-3-en-1-one
SpectraBase Compound ID 3w6hfW3orEy
InChI InChI=1S/C22H28O5/c1-14(6-7-15(2)23)10-16-8-9-18(24)13-19(16)17-11-20(25-3)22(27-5)21(12-17)26-4/h11-12H,1,6-10,13H2,2-5H3
InChIKey DIOFAWDOHKVZDT-UHFFFAOYSA-N
Mol Weight 372.46 g/mol
Molecular Formula C22H28O5
Exact Mass 372.193674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6UKPj3ThJwd
Name 4-[2-(3-Oxobutyl)prop-2-en-1-yl]-3-(3,4,5-trimethoxyphenyl)-cyclohex-3-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H28O5
InChI InChI=1S/C22H28O5/c1-14(6-7-15(2)23)10-16-8-9-18(24)13-19(16)17-11-20(25-3)22(27-5)21(12-17)26-4/h11-12H,1,6-10,13H2,2-5H3
InChIKey DIOFAWDOHKVZDT-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo301028b
Molecular Weight 372.461 g/mol
SMILES C1C(=O)CC(c2cc(OC)c(c(c2)OC)OC)=C(CC(CCC(C)=O)=C)C1
SPLASH splash10-000x-9003000000-fe885c88556e91fb6edc
Source of Spectrum J-77-8383-11g
Synonyms 3',4',5'-trimethoxy-6-(2-methylene-5-oxohexyl)-4,5-dihydro-[1,1'-biphenyl]-3(2H)-one 4-(2-Methylene-5-oxohexyl)-3-(3,4,5-trimethoxyphenyl)-1-cyclohex-3-enone 4-(2-Methylidene-5-oxohexyl)-3-(3,4,5-trimethoxyphenyl)cyclohex-3-en-1-one 4-(2-Methylene-5-oxo-hexyl)-3-(3,4,5-trimethoxyphenyl)cyclohex-3-en-1-one 4-(2-Methylidene-5-oxidanylidene-hexyl)-3-(3,4,5-trimethoxyphenyl)cyclohex-3-en-1-one
Wiley ID 1745192