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2-(3,3-Dimethyl-oxiranyl)-1-phenyl-ethanone
SpectraBase Compound ID BJwpJGZrsuR
InChI InChI=1S/C12H14O2/c1-12(2)11(14-12)8-10(13)9-6-4-3-5-7-9/h3-7,11H,8H2,1-2H3
InChIKey JVVWTVVCYTUTQM-UHFFFAOYSA-N
Mol Weight 190.24 g/mol
Molecular Formula C12H14O2
Exact Mass 190.09938 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4Adapq6USbs
Name 2-(3,3-Dimethyl-oxiranyl)-1-phenyl-ethanone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 190.099379689 u
Formula C12H14O2
InChI InChI=1S/C12H14O2/c1-12(2)11(14-12)8-10(13)9-6-4-3-5-7-9/h3-7,11H,8H2,1-2H3
InChIKey JVVWTVVCYTUTQM-UHFFFAOYSA-N
Molecular Weight 190.242 g/mol
SMILES C1(OC1(C)C)CC(=O)C1=CC=CC=C1