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(1R,2R,4R)-Bicyclo-[2.2.1]-hept-5-ene-2-carboxylic-acid-2,2,2-trifluoro-ethylester
SpectraBase Compound ID 1kOICIdh0Gf
InChI InChI=1S/C10H11F3O2/c11-10(12,13)5-15-9(14)8-4-6-1-2-7(8)3-6/h1-2,6-8H,3-5H2/t6-,7+,8-/m1/s1
InChIKey JCEBJANJSMTYJD-GJMOJQLCSA-N
Mol Weight 220.19 g/mol
Molecular Formula C10H11F3O2
Exact Mass 220.071114 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JGhfUaedk6t
Name (1R,2R,4R)-Bicyclo-[2.2.1]-hept-5-ene-2-carboxylic-acid-2,2,2-trifluoro-ethylester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 220.071114081 u
Formula C10H11F3O2
InChI InChI=1S/C10H11F3O2/c11-10(12,13)5-15-9(14)8-4-6-1-2-7(8)3-6/h1-2,6-8H,3-5H2/t6-,7+,8-/m1/s1
InChIKey JCEBJANJSMTYJD-GJMOJQLCSA-N
Molecular Weight 220.191 g/mol
SMILES [C@]1([H])([C@]2(C=C[C@@](C1)(C2)[H])[H])C(=O)OCC(F)(F)F