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3-Hexanone, 2-chloro-5-methyl-5-(5-methyl-2-furanyl)-, (.+-.)-

View entire compound with spectra: 1 MS (GC)

3-Hexanone, 2-chloro-5-methyl-5-(5-methyl-2-furanyl)-, (.+-.)-
SpectraBase Compound ID D1PAbmdmlha
InChI InChI=1S/C12H17ClO2/c1-8-5-6-11(15-8)12(3,4)7-10(14)9(2)13/h5-6,9H,7H2,1-4H3
InChIKey KIUQEPMASDSJJR-UHFFFAOYSA-N
Mol Weight 228.72 g/mol
Molecular Formula C12H17ClO2
Exact Mass 228.091707 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FJDHkOfjFF8
Name 3-Hexanone, 2-chloro-5-methyl-5-(5-methyl-2-furanyl)-, (.+-.)-
Alternate Name(s) 2-Chloro-5-methyl-5-(5-methyl-2-furyl)-3-hexanone 2-Chloro-5-methyl-5-(5-methylfuran-2-yl)hexan-3-one
CAS Registry Number 125254-60-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17ClO2
InChI InChI=1S/C12H17ClO2/c1-8-5-6-11(15-8)12(3,4)7-10(14)9(2)13/h5-6,9H,7H2,1-4H3
InChIKey KIUQEPMASDSJJR-UHFFFAOYSA-N
Molecular Weight 228.719 g/mol
SMILES c1(oc(C)cc1)C(CC(=O)C(Cl)C)(C)C
SPLASH splash10-00di-2900000000-442746effbcfd9627865
Source of Spectrum H-72-764-35
Wiley ID 1229465