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3-Hydroxy-3-methylnonanoic acid ethyl ester

View entire compound with spectra: 1 MS (GC)

3-Hydroxy-3-methylnonanoic acid ethyl ester
SpectraBase Compound ID LdSxXPHflup
InChI InChI=1S/C12H24O3/c1-4-6-7-8-9-12(3,14)10-11(13)15-5-2/h14H,4-10H2,1-3H3
InChIKey NXRBXPDEFDUATB-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 5WkTkwDunV1
Name 3-Hydroxy-3-methylnonanoic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H24O3
InChI InChI=1S/C12H24O3/c1-4-6-7-8-9-12(3,14)10-11(13)15-5-2/h14H,4-10H2,1-3H3
InChIKey NXRBXPDEFDUATB-UHFFFAOYSA-N
Molecular Weight 216.321 g/mol
SMILES OC(CC(=O)OCC)(CCCCCC)C
SPLASH splash10-001i-5900000000-fa0266c1aaf86a439898
Source of Spectrum F-54-10835-5
Synonyms 3-Hydroxy-3-methyl-pelargonic acid ethyl ester Ethyl 3-hydroxy-3-methyl-nonanoate Ethyl 3-methyl-3-oxidanyl-nonanoate
Wiley ID 808576