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Acetic acid, cis-2-(3-acetonyl-2,2-dimethyl-1-cyclopropyl)-(E)-vinyl ester
SpectraBase Compound ID 4S7S5flQHKj
InChI InChI=1S/C12H18O3/c1-8(13)7-11-10(12(11,3)4)5-6-15-9(2)14/h5-6,10-11H,7H2,1-4H3/b6-5+
InChIKey UJTGILZNIOEWLG-AATRIKPKSA-N
Mol Weight 210.27 g/mol
Molecular Formula C12H18O3
Exact Mass 210.125594 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JUvbQCA3kKQ
Name Acetic acid, cis-2-(3-acetonyl-2,2-dimethyl-1-cyclopropyl)-(E)-vinyl ester
CAS Registry Number 119242-80-7
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H18O3
InChI InChI=1S/C12H18O3/c1-8(13)7-11-10(12(11,3)4)5-6-15-9(2)14/h5-6,10-11H,7H2,1-4H3/b6-5+
InChIKey UJTGILZNIOEWLG-AATRIKPKSA-N
Instrument Name Varian CFT-20
Literature Reference N.C. Rol, A.D. Clague, Org. Magn. Resonance 16, 187 (1981).
NMR Standard CDCl3
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3