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1,1-Dimethylethyl 2-(hydroxymethyl)-3-oxo-3-phenylpropanoate
SpectraBase Compound ID JLS21L5IwXk
InChI InChI=1S/C14H18O4/c1-14(2,3)18-13(17)11(9-15)12(16)10-7-5-4-6-8-10/h4-8,11,15H,9H2,1-3H3
InChIKey WRIIMYLIUPNWBD-UHFFFAOYSA-N
Mol Weight 250.29 g/mol
Molecular Formula C14H18O4
Exact Mass 250.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E42tjsp1ukh
Name 1,1-Dimethylethyl 2-(hydroxymethyl)-3-oxo-3-phenylpropanoate
CAS Registry Number 135514-08-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O4
InChI InChI=1S/C14H18O4/c1-14(2,3)18-13(17)11(9-15)12(16)10-7-5-4-6-8-10/h4-8,11,15H,9H2,1-3H3
InChIKey WRIIMYLIUPNWBD-UHFFFAOYSA-N
Molecular Weight 250.294 g/mol
SMILES OCC(C(OC(C)(C)C)=O)C(=O)c1ccccc1
SPLASH splash10-0a4i-0900000000-ae375eaaafe4cf1b31f1
Source of Spectrum K-124-2479-13
Synonyms tert-Butyl 2-(hydroxymethyl)-3-oxo-3-phenylpropanoate
Wiley ID 1253368