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FHSRSGWJELTOBB-UHFFFAOYSA-N
SpectraBase Compound ID 3dYEOJHpu6U
InChI InChI=1S/C25H25N3O2/c1-25(2)12-20-23(21(29)13-25)22(19(14-26)24(27)28-20)17-8-10-18(11-9-17)30-15-16-6-4-3-5-7-16/h3-11,22,28H,12-13,15,27H2,1-2H3
InChIKey FHSRSGWJELTOBB-UHFFFAOYSA-N
Mol Weight 399.49 g/mol
Molecular Formula C25H25N3O2
Exact Mass 399.194677 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FwX9FYm3W5K
Name 2-AMINO-3-CYANO-7,7-DIMETHYL-4-(4'-BENZYLOXYPHENYL)-5,6,7,8-TETRAHYDRO-4H-CHROMENE
Compound Number 2E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H25N3O2
InChI InChI=1S/C25H25N3O2/c1-25(2)12-20-23(21(29)13-25)22(19(14-26)24(27)28-20)17-8-10-18(11-9-17)30-15-16-6-4-3-5-7-16/h3-11,22,28H,12-13,15,27H2,1-2H3
InChIKey FHSRSGWJELTOBB-UHFFFAOYSA-N
Literature Reference Author M.SUAREZ,D.MOLERO,E.SALFRAN,N.MARTIN,Y.VERDECIA,R.MARTINEZ,E .OCHOA,L.ALBA,M.QUIN
Literature Reference Citation MAGN.RES.CHEM.,39,105(2001)
Literature Reference DOI 10.1002/1097-458x(200102)39:2<105::aid-mrc809>3.3.co;2-v
Molecular Weight 399.492 g/mol
Solvent DMSO-D6
Source File Reference UWSI24847