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3,5,5-trimethyl-4-methylidenecyclohex-2-en-1-one
SpectraBase Compound ID L60WArOSkwP
InChI InChI=1S/C10H14O/c1-7-5-9(11)6-10(3,4)8(7)2/h5H,2,6H2,1,3-4H3
InChIKey MCGQFKNFKWPWAA-UHFFFAOYSA-N
Mol Weight 150.22 g/mol
Molecular Formula C10H14O
Exact Mass 150.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7u2zVXMNDn7
Name Isophorone-4-methylene
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 150.104465070 u
Formula C10H14O
InChI InChI=1S/C10H14O/c1-7-5-9(11)6-10(3,4)8(7)2/h5H,2,6H2,1,3-4H3
InChIKey MCGQFKNFKWPWAA-UHFFFAOYSA-N
Instrument Name HP 5890 Series II-5972
Ionization Type EI
Literature Reference DOI 10.1002/jsfa.3679
Molecular Weight 150.221 g/mol
Number of Peaks 4
SMILES C=C1C(=CC(=O)CC1(C)C)C
SPLASH splash10-0a4i-2900000000-ab3a9f29d17f6a77d511
Source of Spectrum SFA-89-1953-11 (DOI: 10.1002/jsfa.3679)
Wiley ID 1840243