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S-(-)-7,8-DIDEHYDROCORYDALMINIUM_TRIFLUOROACETATE

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S-(-)-7,8-DIDEHYDROCORYDALMINIUM_TRIFLUOROACETATE
SpectraBase Compound ID 2BEYc1tYlu5
InChI InChI=1S/C20H21NO4.C2HF3O2/c1-23-18-9-13-6-7-21-11-15-12(4-5-17(22)20(15)25-3)8-16(21)14(13)10-19(18)24-2;3-2(4,5)1(6)7/h4-5,9-11,16H,6-8H2,1-3H3;(H,6,7)
InChIKey JXMGCJNBVUYMLA-UHFFFAOYSA-N
Mol Weight 453.41 g/mol
Molecular Formula C22H22F3NO6
Exact Mass 453.139922 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6d8iNZYUMUX
Name S-(-)-7,8-DIDEHYDROCORYDALMINIUM_TRIFLUOROACETATE
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H22F3NO6
InChI InChI=1S/C20H21NO4.C2HF3O2/c1-23-18-9-13-6-7-21-11-15-12(4-5-17(22)20(15)25-3)8-16(21)14(13)10-19(18)24-2;3-2(4,5)1(6)7/h4-5,9-11,16H,6-8H2,1-3H3;(H,6,7)
InChIKey JXMGCJNBVUYMLA-UHFFFAOYSA-N
Literature Reference Author S.F.TSAI,S.S.LEE
Literature Reference Citation J.NAT.PROD.,73,1632(2010)
Literature Reference DOI 10.1021/np100247r
Molecular Weight 453.415 g/mol
Sample ID 36179
Solvent CD3OD