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2-Methyl-butyric acid, methyl ester
SpectraBase Compound ID L5fgagH78mj
InChI InChI=1S/C6H12O2/c1-4-5(2)6(7)8-3/h5H,4H2,1-3H3
InChIKey OCWLYWIFNDCWRZ-UHFFFAOYSA-N
Mol Weight 116.16 g/mol
Molecular Formula C6H12O2
Exact Mass 116.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FBa3087CEi6
Name Methyl 2-methylbutyrate
Carrier Gas Helium (150 kPa)
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Exact Mass 116.083729624 u
Formula C6H12O2
GC Column Superox(TM) or DB-5 (30 m x 0.32 mm, film thickness 0.7 micrometer or 1 micrometer)
GC Oven Program Oven temp 250oC
InChI InChI=1S/C6H12O2/c1-4-5(2)6(7)8-3/h5H,4H2,1-3H3
InChIKey OCWLYWIFNDCWRZ-UHFFFAOYSA-N
Inlet Type split (1:10)
Instrument Name HRGC-MS
Ionization Type EI
Literature Reference DOI 10.1002/jhrc.1240200507
Molecular Weight 116.160 g/mol
Quality 557
SMILES COC(C(CC)C)=O
SPLASH splash10-052f-9000000000-17f498158ab44722c658
Source of Spectrum HRC-20-276-9 (DOI: 10.1002/jhrc.1240200507)
Wiley ID 1910947