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Methyl 4-hydroxy-2-methylene-4-phenylpentanoate
SpectraBase Compound ID G616bBtDf4T
InChI InChI=1S/C13H16O3/c1-10(12(14)16-3)9-13(2,15)11-7-5-4-6-8-11/h4-8,15H,1,9H2,2-3H3
InChIKey XVRGQXUPJJAFLH-UHFFFAOYSA-N
Mol Weight 220.27 g/mol
Molecular Formula C13H16O3
Exact Mass 220.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EbHFFT7VYd7
Name Methyl 4-hydroxy-2-methylene-4-phenylpentanoate
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O3
InChI InChI=1S/C13H16O3/c1-10(12(14)16-3)9-13(2,15)11-7-5-4-6-8-11/h4-8,15H,1,9H2,2-3H3
InChIKey XVRGQXUPJJAFLH-UHFFFAOYSA-N
Instrument Name Agilent Technologies GC/MS-5973N
Ionization Type EI
Literature Reference DOI 10.1002/aoc.6418
Molecular Weight 220.268 g/mol
SMILES OC(CC(C(OC)=O)=C)(C)c1ccccc1
SPLASH splash10-00di-1900000000-fc12988a562d37aeb565
Source of Spectrum AOC-35-SM8-3o
Thin-Layer Chromatography Rf = 0.5 (hexane/ethyl acetate, 7:3)
Wiley ID 1866450