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Hexanoic acid, 3-hydroxy-5-methyl-2-(1-methylethyl)-, methyl ester
SpectraBase Compound ID GcWnqe9316L
InChI InChI=1S/C11H22O3/c1-7(2)6-9(12)10(8(3)4)11(13)14-5/h7-10,12H,6H2,1-5H3
InChIKey PIMRDOXUQHYXPJ-UHFFFAOYSA-N
Mol Weight 202.29 g/mol
Molecular Formula C11H22O3
Exact Mass 202.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BlpsM6pcgC9
Name Methyl 3-hydroxy-2-isopropyl-5-methylhexanoate
CAS Registry Number 40853-50-7
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H22O3
InChI InChI=1S/C11H22O3/c1-7(2)6-9(12)10(8(3)4)11(13)14-5/h7-10,12H,6H2,1-5H3
InChIKey PIMRDOXUQHYXPJ-UHFFFAOYSA-N
Molecular Weight 202.294 g/mol
SMILES OC(CC(C)C)C(C(C)C)C(=O)OC
SPLASH splash10-0fr6-9500000000-f9352d65b49bd13456ed
Source of Spectrum HE-1986-1910-0
Synonyms 3-Hydroxy-2-isopropyl-5-methyl-hexanoic acid methyl ester 3-Hydroxy-5-methyl-2-propan-2-ylhexanoic acid methyl ester Hexanoic acid, 3-hydroxy-5-methyl-2-(1-methylethyl)-, methyl ester Methyl 3-hydroxy-5-methyl-2-propan-2-ylhexanoate Methyl 5-methyl-3-oxidanyl-2-propan-2-yl-hexanoate
Wiley ID 1199727