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2-ketochromene-3-carboxylic acid tert-butyl ester

View entire compound with spectra: 1 MS (GC)

2-ketochromene-3-carboxylic acid tert-butyl ester
SpectraBase Compound ID Hi376Lo1XI6
InChI InChI=1S/C14H14O4/c1-14(2,3)18-13(16)10-8-9-6-4-5-7-11(9)17-12(10)15/h4-8H,1-3H3
InChIKey LJCZSMJHDOEFPS-UHFFFAOYSA-N
Mol Weight 246.26 g/mol
Molecular Formula C14H14O4
Exact Mass 246.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Eu7ptt4gebu
Name 2-ketochromene-3-carboxylic acid tert-butyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14O4
InChI InChI=1S/C14H14O4/c1-14(2,3)18-13(16)10-8-9-6-4-5-7-11(9)17-12(10)15/h4-8H,1-3H3
InChIKey LJCZSMJHDOEFPS-UHFFFAOYSA-N
Molecular Weight 246.262 g/mol
SMILES C1(C(=Cc2ccccc2O1)C(=O)OC(C)(C)C)=O
SPLASH splash10-052g-6900000000-ecf891e6e4db6faa4f28
Source of Spectrum C5-2004-681-3
Synonyms 2-Oxo-1-benzopyran-3-carboxylic acid tert-butyl ester tert-Butyl 2-oxidanylidenechromene-3-carboxylate tert-Butyl 2-oxochromene-3-carboxylate
Wiley ID 1616785