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3-Methyl-2-cyclohexen-1-one
SpectraBase Compound ID GH5Hogdlao9
InChI InChI=1S/C7H10O/c1-6-3-2-4-7(8)5-6/h5H,2-4H2,1H3
InChIKey IITQJMYAYSNIMI-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 57iLj6dG4j4
Name Seudenone
Source of Sample SAFC Cat.no. W336009
CAS Registry Number 1193-18-6
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 110.073164941 u
Formula C7H10O
InChI InChI=1S/C7H10O/c1-6-3-2-4-7(8)5-6/h5H,2-4H2,1H3
InChIKey IITQJMYAYSNIMI-UHFFFAOYSA-N
Molecular Weight 110.156 g/mol
Number of Peaks 50
RI1 1055
RI2 728
RI3 969
RI4 924
SMILES C1(C=C(CCC1)C)=O
SPLASH splash10-001i-9100000000-750d0449037ebb1f8940
Sample Comments RI1: measured on SLB-5ms (Hydro) RI2: measured on SLB-5ms (FAMEs) RI3: measured on Supelcowax-10 (FAMEs) RI4: measured on Supelcowax-10 (FAEEs) RI5: measured on Equity-1 (Hydro)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 2-Cyclohexen-1-one, 3-methyl-
Wiley ID LM_FFNSC3_406