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3-Methylenehex-5-en-2-one
SpectraBase Compound ID AyVjkmq5jbg
InChI InChI=1S/C7H10O/c1-4-5-6(2)7(3)8/h4H,1-2,5H2,3H3
InChIKey HTGMAGLWWIGJHZ-UHFFFAOYSA-N
Mol Weight 110.16 g/mol
Molecular Formula C7H10O
Exact Mass 110.073165 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ln6ckjwnD5n
Name 3-methylenehex-5-en-2-one
Appearance Colourless liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 110.073164941 u
Formula C7H10O
InChI InChI=1S/C7H10O/c1-4-5-6(2)7(3)8/h4H,1-2,5H2,3H3
InChIKey HTGMAGLWWIGJHZ-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/anie.201707069
Molecular Weight 110.156 g/mol
Quality 286
Reported Formula C7H10O
SMILES C(C(=O)C)(CC=C)=C
SPLASH splash10-00kf-9100000000-106301aa545415cce561
Source of Spectrum ACI-56-SM15-25 (DOI: 10.1002/anie.201707069)
Thin-Layer Chromatography 0.39 (petroleum ether/ethyl acetate, 15:1)
Wiley ID 1896601