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3,4-TETRAMETHYLENE-5-CARBOXYISOXAZOLE
SpectraBase Compound ID AtBKD5LCbkA
InChI InChI=1S/C8H9NO3/c10-8(11)7-5-3-1-2-4-6(5)9-12-7/h1-4H2,(H,10,11)
InChIKey RZZGDFMRRLFKRP-UHFFFAOYSA-N
Mol Weight 167.16 g/mol
Molecular Formula C8H9NO3
Exact Mass 167.058243 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ALgYYAwHlly
Name 3,4-TETRAMETHYLENE-5-CARBOXYISOXAZOLE
Compound Number 5E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H9NO3
InChI InChI=1S/C8H9NO3/c10-8(11)7-5-3-1-2-4-6(5)9-12-7/h1-4H2,(H,10,11)
InChIKey RZZGDFMRRLFKRP-UHFFFAOYSA-N
Literature Reference Author M.A.P.MARTINS,S.BRONDANI,V.L.LEIDENS,D.C.FLORES,S.MOURA,N.ZA NATTA,M.HOERNER,A.F.
Literature Reference Citation CAN.J.CHEM.,83,1171(2005)
Literature Reference DOI 10.1139/v05-130
Molecular Weight 167.164 g/mol
Solvent CDCl3;0.02M
Source File Reference UWLU30296