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1-(ACETYLOXY)-3,3-DIMETHYL-2-BUTANONE
SpectraBase Compound ID JpYNgzVwin8
InChI InChI=1S/C8H14O3/c1-6(9)11-5-7(10)8(2,3)4/h5H2,1-4H3
InChIKey WRHRPYRPXMFKJG-UHFFFAOYSA-N
Mol Weight 158.2 g/mol
Molecular Formula C8H14O3
Exact Mass 158.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1wSY3xXskcG
Name (3,3-dimethyl-2-oxidanylidene-butyl) ethanoate
CAS Registry Number 38559-25-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O3
InChI InChI=1S/C8H14O3/c1-6(9)11-5-7(10)8(2,3)4/h5H2,1-4H3
InChIKey WRHRPYRPXMFKJG-UHFFFAOYSA-N
Molecular Weight 158.197 g/mol
SMILES C(C(C)(C)C)(COC(=O)C)=O
SPLASH splash10-0a4i-9000000000-d9f645b223c0ea8dcc09
Source of Spectrum J-57-4268-0
Synonyms (3,3-dimethyl-2-oxo-butyl) acetate Acetic acid (2-keto-3,3-dimethyl-butyl) ester Acetic acid (3,3-dimethyl-2-oxobutyl) ester
Wiley ID 1155243