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Methyl (E)-4-methyl-2-octenoate
SpectraBase Compound ID 1vB8tEhwWmY
InChI InChI=1S/C10H18O2/c1-4-5-6-9(2)7-8-10(11)12-3/h7-9H,4-6H2,1-3H3/b8-7+
InChIKey IYQJAPLAZKNVHL-BQYQJAHWSA-N
Mol Weight 170.25 g/mol
Molecular Formula C10H18O2
Exact Mass 170.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 13v5WUox8K
Name Methyl (E)-4-methyl-2-octenoate
Appearance Colorless liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18O2
InChI InChI=1S/C10H18O2/c1-4-5-6-9(2)7-8-10(11)12-3/h7-9H,4-6H2,1-3H3/b8-7+
InChIKey IYQJAPLAZKNVHL-BQYQJAHWSA-N
Instrument Name Thermo Scientific ISQ OD
Ionization Type EI
Literature Reference DOI 10.1002/cbic.201900375
Molecular Weight 170.252 g/mol
Reported Formula C10H18O2
SMILES CC(\C=C\C(OC)=O)CCCC
SPLASH splash10-055b-9300000000-623d44266954120c76b9
Source of Spectrum CBC-21-377-6b
Thin-Layer Chromatography Rf = 0.62 (SiO2, Hexanes/MTBE, 1:1)
Wiley ID 1839752