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1,4-butanediol, diacetoacetate

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1,4-butanediol, diacetoacetate
SpectraBase Compound ID AJLsKvGptOi
InChI InChI=1S/C12H18O6/c1-9(13)7-11(15)17-5-3-4-6-18-12(16)8-10(2)14/h3-8H2,1-2H3
InChIKey IHSFHIUGYHMYNR-UHFFFAOYSA-N
Mol Weight 258.27 g/mol
Molecular Formula C12H18O6
Exact Mass 258.110338 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2z3LOOGXFI8
Name 1,4-BUTANEDIOL, DIACETOACETATE
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Comments Enol form present
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O6
InChI InChI=1S/C12H18O6/c1-9(13)7-11(15)17-5-3-4-6-18-12(16)8-10(2)14/h3-8H2,1-2H3
InChIKey IHSFHIUGYHMYNR-UHFFFAOYSA-N
Molecular Weight 258.27
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300
Synonyms ACETOACETIC ACID, TETRAMETHYLENE ESTER