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(2S)-Acetic acid [2-isopropyl-2-methyl-3-oxobutyl]ester
SpectraBase Compound ID 8Xgeyh1Nmw5
InChI InChI=1S/C10H18O3/c1-7(2)10(5,8(3)11)6-13-9(4)12/h7H,6H2,1-5H3/t10-/m1/s1
InChIKey QQUJNKNHYBAKEJ-SNVBAGLBSA-N
Mol Weight 186.25 g/mol
Molecular Formula C10H18O3
Exact Mass 186.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D3g6itJ8v0M
Name (2S)-Acetic acid [2-isopropyl-2-methyl-3-oxobutyl]ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18O3
InChI InChI=1S/C10H18O3/c1-7(2)10(5,8(3)11)6-13-9(4)12/h7H,6H2,1-5H3/t10-/m1/s1
InChIKey QQUJNKNHYBAKEJ-SNVBAGLBSA-N
Literature Reference DOI 10.1002/hlca.19810640315
Molecular Weight 186.251 g/mol
SMILES CC(=O)[C@@](COC(=O)C)(C)C(C)C
SPLASH splash10-00l6-9000000000-e12b56ae30f40066bf8f
Source of Spectrum H-64-766-rac_6
Synonyms (S)-2-acetyl-2,3-dimethylbutyl acetate
Wiley ID 1794769