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2-keto-4,5,5-trimethyl-3-furoic acid
SpectraBase Compound ID 5J2eUPJ7BCL
InChI InChI=1S/C8H10O4/c1-4-5(6(9)10)7(11)12-8(4,2)3/h1-3H3,(H,9,10)
InChIKey WDBWMWDAYBDTOO-UHFFFAOYSA-N
Mol Weight 170.16 g/mol
Molecular Formula C8H10O4
Exact Mass 170.057909 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID W0RVN954P1
Name 2-keto-4,5,5-trimethyl-3-furoic acid
CAS Registry Number 13156-11-1
Compound Number 22A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H10O4
InChI InChI=1S/C8H10O4/c1-4-5(6(9)10)7(11)12-8(4,2)3/h1-3H3,(H,9,10)
InChIKey WDBWMWDAYBDTOO-UHFFFAOYSA-N
Literature Reference Author T.SAKAI,T.KATAYAMA,A.TAKEDA
Literature Reference Citation J.ORG.CHEM.,46,2924(1981)
Literature Reference DOI 10.1021/jo00327a017
Molecular Weight 170.165 g/mol
Solvent CDCl3
Source File Reference UNIW20563