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3,4-HEXAMETHYLENE-5-CARBOXYISOXAZOLE
SpectraBase Compound ID Hst0NhwNT92
InChI InChI=1S/C10H13NO3/c12-10(13)9-7-5-3-1-2-4-6-8(7)11-14-9/h1-6H2,(H,12,13)
InChIKey ZOMOCIMHAGXTEE-UHFFFAOYSA-N
Mol Weight 195.22 g/mol
Molecular Formula C10H13NO3
Exact Mass 195.089543 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EW2M1IHdufW
Name 3,4-HEXAMETHYLENE-5-CARBOXYISOXAZOLE
Compound Number 5H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H13NO3
InChI InChI=1S/C10H13NO3/c12-10(13)9-7-5-3-1-2-4-6-8(7)11-14-9/h1-6H2,(H,12,13)
InChIKey ZOMOCIMHAGXTEE-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 195.218 g/mol
Solvent CDCl3;0.02M
Source File Reference UWLU30299