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3-TRIFLUOROMETHYL-2-IODOOXIRAN-2-CARBOXYLIC-ACID-ETHYLESTER
SpectraBase Compound ID 9OiMXa8TJks
InChI InChI=1S/C6H6F3IO3/c1-2-12-4(11)5(10)3(13-5)6(7,8)9/h3H,2H2,1H3/t3-,5-/m1/s1
InChIKey XQKXYNOBBCZYKN-NQXXGFSBSA-N
Mol Weight 310.01 g/mol
Molecular Formula C6H6F3IO3
Exact Mass 309.931374 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1AWU5lAeKcw
Name 3-TRIFLUOROMETHYL-2-IODOOXIRAN-2-CARBOXYLIC-ACID-ETHYLESTER
CAS Registry Number 139657-77-5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H6F3IO3
InChI InChI=1S/C6H6F3IO3/c1-2-12-4(11)5(10)3(13-5)6(7,8)9/h3H,2H2,1H3/t3-,5-/m1/s1
InChIKey XQKXYNOBBCZYKN-NQXXGFSBSA-N
Literature Reference Author C.VONDEMBUSSCHE-HUENNEFELD,D.SEEBACH
Literature Reference Citation CHEM.BER.,125,1273(1992)
Literature Reference DOI 10.1002/cber.19921250538
Molecular Weight 310.012 g/mol
Solvent CDCl3
Source File Reference UWCS7475