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2-Tert-Butyl-2-prop-2-ynylmalonic acid diethyl ester
SpectraBase Compound ID FbtooVJdjk9
InChI InChI=1S/C14H22O4/c1-7-10-14(13(4,5)6,11(15)17-8-2)12(16)18-9-3/h1H,8-10H2,2-6H3
InChIKey HDUJANFMPIDJRZ-UHFFFAOYSA-N
Mol Weight 254.33 g/mol
Molecular Formula C14H22O4
Exact Mass 254.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fs1SrLhXBGi
Name 2-Tert-Butyl-2-prop-2-ynylmalonic acid diethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O4
InChI InChI=1S/C14H22O4/c1-7-10-14(13(4,5)6,11(15)17-8-2)12(16)18-9-3/h1H,8-10H2,2-6H3
InChIKey HDUJANFMPIDJRZ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200505211
Molecular Weight 254.326 g/mol
SMILES C(C(C(=O)OCC)(CC#C)C(C)(C)C)(=O)OCC
SPLASH splash10-0002-6900000000-11796d6a31fa888a6857
Source of Spectrum ASC-347-1587/SM4-1h
Synonyms Diethyl 2-(tert-butyl)-2-(prop-2-yn-1-yl)malonate
Wiley ID 1767749