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(1S,4R)-7-AZABICYCLO-[2.2.1]-HEPTAN-2-ONE-1-CARBOXYLIC-ACID-METHYLESTER-TRIFLUOROACETATE-SALT
SpectraBase Compound ID GTgg2PiJhLN
InChI InChI=1S/C8H11NO3.C2HF3O2/c1-12-7(11)8-3-2-5(9-8)4-6(8)10;3-2(4,5)1(6)7/h5,9H,2-4H2,1H3;(H,6,7)/t5-,8+;/m0./s1
InChIKey CKJFEPKHODMZCN-ZZLSTCIUSA-N
Mol Weight 283.2 g/mol
Molecular Formula C10H12F3NO5
Exact Mass 283.066757 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K0p4iMxEmNL
Name (1S,4R)-7-AZABICYCLO-[2.2.1]-HEPTAN-2-ONE-1-CARBOXYLIC-ACID-METHYLESTER-TRIFLUOROACETATE-SALT
Compound Number 12
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H12F3NO5
InChI InChI=1S/C8H11NO3.C2HF3O2/c1-12-7(11)8-3-2-5(9-8)4-6(8)10;3-2(4,5)1(6)7/h5,9H,2-4H2,1H3;(H,6,7)/t5-,8+;/m0./s1
InChIKey CKJFEPKHODMZCN-ZZLSTCIUSA-N
Literature Reference Author A.AVENOZA,J.I.BARRIOBERO,J.H.BUSTO,J.M.PEREGRINA
Literature Reference Citation J.ORG.CHEM.,68,2889(2003)
Literature Reference DOI 10.1021/jo026804+
Molecular Weight 283.204 g/mol
Solvent CDCl3
Source File Reference UWSI22596