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ACETOACETIC ACID, 2-ISOPROPYL-, ETHYL ESTER
SpectraBase Compound ID 3obw5czmxTC
InChI InChI=1S/C9H16O3/c1-5-12-9(11)8(6(2)3)7(4)10/h6,8H,5H2,1-4H3
InChIKey DMIFFKCVURTPTG-UHFFFAOYSA-N
Mol Weight 172.22 g/mol
Molecular Formula C9H16O3
Exact Mass 172.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BJQFkHlJfWE
Name 2-Isopropyl-3-oxobutyric acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O3
InChI InChI=1S/C9H16O3/c1-5-12-9(11)8(6(2)3)7(4)10/h6,8H,5H2,1-4H3
InChIKey DMIFFKCVURTPTG-UHFFFAOYSA-N
Molecular Weight 172.224 g/mol
SMILES C(C(C(C)=O)C(C)C)(=O)OCC
SPLASH splash10-015l-8900000000-fa3d964ab0921fa7fc7a
Source of Spectrum H-64-764-764_1
Synonyms Ethyl 2-acetyl-3-methylbutanoate
Wiley ID 1794768