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3-(1-OXOPROPOXY)-2-BUTANONE
SpectraBase Compound ID 2clwUI3pLNo
InChI InChI=1S/C7H12O3/c1-4-7(9)10-6(3)5(2)8/h6H,4H2,1-3H3
InChIKey IJYLYUNIYOAVJM-UHFFFAOYSA-N
Mol Weight 144.17 g/mol
Molecular Formula C7H12O3
Exact Mass 144.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 755PSNateEd
Name (1-methyl-2-oxo-propyl) propanoate
Alternate Name(s) 3-Oxidanylidenebutan-2-yl propanoate 3-Oxobutan-2-yl propanoate Propanoic acid 3-oxobutan-2-yl ester Propionic acid (2-keto-1-methyl-propyl) ester
CAS Registry Number 141665-40-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12O3
InChI InChI=1S/C7H12O3/c1-4-7(9)10-6(3)5(2)8/h6H,4H2,1-3H3
InChIKey IJYLYUNIYOAVJM-UHFFFAOYSA-N
Molecular Weight 144.170 g/mol
SMILES C(OC(C(=O)C)C)(=O)CC
SPLASH splash10-0udi-5900000000-5101eb1e85a625f98a5f
Source of Spectrum J-57-4269-0
Wiley ID 1142487