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3-Cyclopropyl-2-butanone
SpectraBase Compound ID DEptIY05C23
InChI InChI=1S/C7H12O/c1-5(6(2)8)7-3-4-7/h5,7H,3-4H2,1-2H3
InChIKey PQNJFTBDGGXZHE-UHFFFAOYSA-N
Mol Weight 112.17 g/mol
Molecular Formula C7H12O
Exact Mass 112.088815 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3z6uuniATtC
Name 3-Cyclopropyl-2-butanone
CAS Registry Number 71058-45-2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C7H12O
InChI InChI=1S/C7H12O/c1-5(6(2)8)7-3-4-7/h5,7H,3-4H2,1-2H3
InChIKey PQNJFTBDGGXZHE-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference D.B. Carr, J. Schwartz, J. Am. Chem. Soc. 101, 3521 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CCl4