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Ethyl (E)-3-(3-(tert-butoxy)-3-oxoprop-1-en-1-yl)benzoate
SpectraBase Compound ID IYTf47uszGR
InChI InChI=1S/C16H20O4/c1-5-19-15(18)13-8-6-7-12(11-13)9-10-14(17)20-16(2,3)4/h6-11H,5H2,1-4H3/b10-9+
InChIKey YDPMLLUFGGKXQH-MDZDMXLPSA-N
Mol Weight 276.33 g/mol
Molecular Formula C16H20O4
Exact Mass 276.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5kkoHmS0Dg0
Name Ethyl (E)-3-(3-(tert-butoxy)-3-oxoprop-1-en-1-yl)benzoate
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O4
InChI InChI=1S/C16H20O4/c1-5-19-15(18)13-8-6-7-12(11-13)9-10-14(17)20-16(2,3)4/h6-11H,5H2,1-4H3/b10-9+
InChIKey YDPMLLUFGGKXQH-MDZDMXLPSA-N
Instrument Name ThermoScientific Focus DSQ II GC/MS
Ionization Type EI positive ion
Literature Reference DOI 10.1002/adsc.202100677
Molecular Weight 276.332 g/mol
SMILES c1(cc(ccc1)\C=C\C(OC(C)(C)C)=O)C(=O)OCC
SPLASH splash10-05di-5950000000-10a513e0137ad57c619c
Source of Spectrum ASC-363-SM11-m-10a
Wiley ID 1851331