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3-(3-Methoxyphenyl)-4-[2-(3-oxobutyl)prop-2-en-1-yl]cyclohex-3-en-1-one
SpectraBase Compound ID LNqsdSfIoG3
InChI InChI=1S/C20H24O3/c1-14(7-8-15(2)21)11-17-9-10-18(22)13-20(17)16-5-4-6-19(12-16)23-3/h4-6,12H,1,7-11,13H2,2-3H3
InChIKey KXLQKYIEZZIHLJ-UHFFFAOYSA-N
Mol Weight 312.41 g/mol
Molecular Formula C20H24O3
Exact Mass 312.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BweU2yALtPQ
Name 3-(3-Methoxyphenyl)-4-[2-(3-oxobutyl)prop-2-en-1-yl]cyclohex-3-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H24O3
InChI InChI=1S/C20H24O3/c1-14(7-8-15(2)21)11-17-9-10-18(22)13-20(17)16-5-4-6-19(12-16)23-3/h4-6,12H,1,7-11,13H2,2-3H3
InChIKey KXLQKYIEZZIHLJ-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo301028b
Molecular Weight 312.409 g/mol
SMILES C1C(=O)CC(=C(C1)CC(CCC(C)=O)=C)c1cc(ccc1)OC
SPLASH splash10-0006-2590000000-50824ad4e6c671f279bf
Source of Spectrum J-77-8383-11f
Synonyms 3'-methoxy-6-(2-methylene-5-oxohexyl)-4,5-dihydro-[1,1'-biphenyl]-3(2H)-one 3-(3-Methoxyphenyl)-4-(2-methylene-5-oxohexyl)-1-cyclohex-3-enone 3-(3-Methoxyphenyl)-4-(2-methylidene-5-oxohexyl)cyclohex-3-en-1-one 3-(3-Methoxyphenyl)-4-(2-methylene-5-oxo-hexyl)cyclohex-3-en-1-one 3-(3-Methoxyphenyl)-4-(2-methylidene-5-oxidanylidene-hexyl)cyclohex-3-en-1-one
Wiley ID 1745191