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acetoacetic acid, sec-butyl ester
SpectraBase Compound ID JsDOKP9PxJi
InChI InChI=1S/C8H14O3/c1-4-7(3)11-8(10)5-6(2)9/h7H,4-5H2,1-3H3
InChIKey QSTNBMLCULGCQE-UHFFFAOYSA-N
Mol Weight 158.2 g/mol
Molecular Formula C8H14O3
Exact Mass 158.094294 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID a24pMgw87M
Name ACETOACETIC ACID, sec-BUTYL ESTER
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
Boiling Point 194C
CAS Registry Number 13562-76-0
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O3
InChI InChI=1S/C8H14O3/c1-4-7(3)11-8(10)5-6(2)9/h7H,4-5H2,1-3H3
InChIKey QSTNBMLCULGCQE-UHFFFAOYSA-N
Molecular Weight 158.20
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300