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(E)-2-methyl-2-hexenoic acid methyl ester
SpectraBase Compound ID 44zG8NRG5O0
InChI InChI=1S/C8H14O2/c1-4-5-6-7(2)8(9)10-3/h6H,4-5H2,1-3H3/b7-6+
InChIKey PSOAOBLLWDXJGD-VOTSOKGWSA-N
Mol Weight 142.2 g/mol
Molecular Formula C8H14O2
Exact Mass 142.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JHPyYYi5IXE
Name Methyl (E)-2-methyl-2-hexenoate
Appearance Colorless liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O2
InChI InChI=1S/C8H14O2/c1-4-5-6-7(2)8(9)10-3/h6H,4-5H2,1-3H3/b7-6+
InChIKey PSOAOBLLWDXJGD-VOTSOKGWSA-N
Instrument Name Thermo Scientific ISQ OD
Ionization Type EI
Literature Reference DOI 10.1002/cbic.201900375
Molecular Weight 142.198 g/mol
Reported Formula C8H14O2
SMILES C\C(C(=O)OC)=C/CCC
SPLASH splash10-0a59-9300000000-c494cd5799da88b0031d
Source of Spectrum CBC-21-379-(E)-11b
Thin-Layer Chromatography Rf = 0.35 (SiO2, Hexanes/MTBE/CH2Cl2, 20:1:0.1)
Wiley ID 1839747