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4-(BENZENESULFONYL)-4-FLUORO-4-NITRO-BUT-2-ENOIC-ACID-ETHYLESTER
SpectraBase Compound ID HMszWBUgvuc
InChI InChI=1S/C12H12FNO6S/c1-2-20-11(15)8-9-12(13,14(16)17)21(18,19)10-6-4-3-5-7-10/h3-9H,2H2,1H3/b9-8+
InChIKey QKRZZXLMNGGXTH-CMDGGOBGSA-N
Mol Weight 317.29 g/mol
Molecular Formula C12H12FNO6S
Exact Mass 317.036936 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6yfJoGRYBQJ
Name 4-(BENZENESULFONYL)-4-FLUORO-4-NITRO-BUT-2-ENOIC-ACID-ETHYLESTER
Compound Number 6L
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H12FNO6S
InChI InChI=1S/C12H12FNO6S/c1-2-20-11(15)8-9-12(13,14(16)17)21(18,19)10-6-4-3-5-7-10/h3-9H,2H2,1H3/b9-8+
InChIKey QKRZZXLMNGGXTH-CMDGGOBGSA-N
Literature Reference Author G.K.S.PRAKASH,X.ZHAO,S.CHACKO,F.WANG,H.VAGHOO,G.A.OLAH
Literature Reference Citation BEIL.J.ORG.CHEM.,4,17,1(2008)
Solvent CDCl3
Source File Reference UWBT10664