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1-(3,5-Dimethoxyphenyl)pent-4-en-2-ol
SpectraBase Compound ID D199YuSLqbk
InChI InChI=1S/C13H18O3/c1-4-5-11(14)6-10-7-12(15-2)9-13(8-10)16-3/h4,7-9,11,14H,1,5-6H2,2-3H3
InChIKey ILBNQPQSEOWOPK-UHFFFAOYSA-N
Mol Weight 222.28 g/mol
Molecular Formula C13H18O3
Exact Mass 222.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1rkPN2dbdxg
Name 1-(3,5-Dimethoxyphenyl)pent-4-en-2-ol
Appearance Oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 222.125594437 u
Formula C13H18O3
InChI InChI=1S/C13H18O3/c1-4-5-11(14)6-10-7-12(15-2)9-13(8-10)16-3/h4,7-9,11,14H,1,5-6H2,2-3H3
InChIKey ILBNQPQSEOWOPK-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1021/jo302572s
Molecular Weight 222.284 g/mol
Quality 39
Reported Formula C13H18O3
SMILES OC(CC=1C=C(C=C(C1)OC)OC)CC=C
SPLASH splash10-0udi-0920000000-d90a6891b75b2ddf6c7f
Source of Spectrum JOC-78-1281-2h (DOI: 10.1021/jo302572s)
Thin-Layer Chromatography 0.25 (EtOAc/hexanes, 1:4)
Wiley ID 1912190