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(2,2-dimethyl-3-oxidanyl-hexyl) butanoate
SpectraBase Compound ID LdtI2tbr8I3
InChI InChI=1S/C12H24O3/c1-5-7-10(13)12(3,4)9-15-11(14)8-6-2/h10,13H,5-9H2,1-4H3
InChIKey MILAEHMPRCLZIF-UHFFFAOYSA-N
Mol Weight 216.32 g/mol
Molecular Formula C12H24O3
Exact Mass 216.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DK9UYLtfkvY
Name (2,2-dimethyl-3-oxidanyl-hexyl) butanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H24O3
InChI InChI=1S/C12H24O3/c1-5-7-10(13)12(3,4)9-15-11(14)8-6-2/h10,13H,5-9H2,1-4H3
InChIKey MILAEHMPRCLZIF-UHFFFAOYSA-N
Molecular Weight 216.321 g/mol
SMILES OC(C(COC(=O)CCC)(C)C)CCC
SPLASH splash10-0abc-9000000000-e18d7b697c9a93accf41
Source of Spectrum IC-553-0-0
Synonyms (3-hydroxy-2,2-dimethyl-hexyl) butanoate 3-Hydroxy-2,2-dimethylhexyl butyrate Butyric acid (3-hydroxy-2,2-dimethyl-hexyl) ester Butanoic acid (3-hydroxy-2,2-dimethylhexyl) ester
Wiley ID 1215587