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Methyl 3-hydroxy-2-methylhexanoate
SpectraBase Compound ID 8CatoX9l2en
InChI InChI=1S/C8H16O3/c1-4-5-7(9)6(2)8(10)11-3/h6-7,9H,4-5H2,1-3H3
InChIKey ZOXSNMQWSRADLU-UHFFFAOYSA-N
Mol Weight 160.21 g/mol
Molecular Formula C8H16O3
Exact Mass 160.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9RUNuxweTip
Name Methyl 3-hydroxy-2-methylhexanoate
Appearance Colorless liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H16O3
InChI InChI=1S/C8H16O3/c1-4-5-7(9)6(2)8(10)11-3/h6-7,9H,4-5H2,1-3H3
InChIKey ZOXSNMQWSRADLU-UHFFFAOYSA-N
Instrument Name Thermo Scientific ISQ OD
Ionization Type EI
Literature Reference DOI 10.1002/cbic.201900375
Molecular Weight 160.213 g/mol
Reported Formula C8H16O3
SMILES OC(CCC)C(C(=O)OC)C
SPLASH splash10-052r-9100000000-50b2e92319970f23da99
Source of Spectrum CBC-21-SM9-12b-major
Thin-Layer Chromatography Rf = 0.36 (SiO2, Hexanes/MTBE, 1:1)
Wiley ID 1839755