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3-Oxohexyl 3-methyl-2-butenoate
SpectraBase Compound ID EhEI1sEBGb4
InChI InChI=1S/C11H18O3/c1-4-5-10(12)6-7-14-11(13)8-9(2)3/h8H,4-7H2,1-3H3
InChIKey MKCAIYQDZDHTMO-UHFFFAOYSA-N
Mol Weight 198.26 g/mol
Molecular Formula C11H18O3
Exact Mass 198.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DtAFukovyEj
Name 3-Oxohexyl 3-methyl-2-butenoate
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O3
InChI InChI=1S/C11H18O3/c1-4-5-10(12)6-7-14-11(13)8-9(2)3/h8H,4-7H2,1-3H3
InChIKey MKCAIYQDZDHTMO-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/cbic.202100372
Molecular Weight 198.262 g/mol
Reported Formula C11H18O3
SMILES CC(=CC(=O)OCCC(=O)CCC)C
SPLASH splash10-001i-9000000000-5fc8e3be935a9a9f579f
Source of Spectrum CBC-22-SM15-34, S4
Wiley ID 1865310