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(S)-METHYL_5,5-DIFLUORO-4-ACETOXY-2-METHYLENEPENTANOATE
SpectraBase Compound ID 48ZIpCrCd7s
InChI InChI=1S/C9H12F2O4/c1-5(9(13)14-3)4-7(8(10)11)15-6(2)12/h7-8H,1,4H2,2-3H3/t7-/m0/s1
InChIKey QCMMMCAHPTWGDR-ZETCQYMHSA-N
Mol Weight 222.19 g/mol
Molecular Formula C9H12F2O4
Exact Mass 222.070365 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4otN1alA64e
Name (S)-METHYL_5,5-DIFLUORO-4-ACETOXY-2-METHYLENEPENTANOATE
Compound Number (S)-4B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H12F2O4
InChI InChI=1S/C9H12F2O4/c1-5(9(13)14-3)4-7(8(10)11)15-6(2)12/h7-8H,1,4H2,2-3H3/t7-/m0/s1
InChIKey QCMMMCAHPTWGDR-ZETCQYMHSA-N
Literature Reference Author Y.KOMATSU,F.SASAKI,S.TAKEI,T.KITAZUME
Literature Reference Citation J.ORG.CHEM.,63,8058(1998)
Literature Reference DOI 10.1021/jo981183z
Solvent CDCl3
Source File Reference UWMZ26446