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Ethyl 4,5-dimethylhex-4-enoate
SpectraBase Compound ID 6BzNubfUCIy
InChI InChI=1S/C10H18O2/c1-5-12-10(11)7-6-9(4)8(2)3/h5-7H2,1-4H3
InChIKey YIBNYCHMVDYKGM-UHFFFAOYSA-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 KkUdNff8qnP
Name Ethyl 4,5-dimethylhex-4-enoate
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18O2
InChI InChI=1S/C10H18O2/c1-5-12-10(11)7-6-9(4)8(2)3/h5-7H2,1-4H3
InChIKey YIBNYCHMVDYKGM-UHFFFAOYSA-N
Instrument Name Agilent 7820A/5975
Ionization Type EI
Literature Reference DOI 10.1002/anie.201813233
Molecular Weight 170.252 g/mol
SMILES C(C)OC(CCC(=C(C)C)C)=O
SPLASH splash10-001i-9200000000-9b03a61168a97a970f58
Source of Spectrum ACI-58-SM10-4
Thin-Layer Chromatography Rf = 0.30 (4% Et2O in Hexanes, KMnO4)
Wiley ID 1843189