John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=4CwNSlOBcwf SpectraBase Spectrum ID=2V5JEo2ytBi

(accessed ).
ISOMER-#1
SpectraBase Compound ID 4CwNSlOBcwf
InChI InChI=1S/C21H23N3O4/c1-26-21(25)17(10-23)15-8-18-16-9-20-19(27-12-28-20)7-13(16)4-6-24(18)11-14(15)3-2-5-22/h7,9,14-15,17-18H,2-4,6,8,11-12H2,1H3/t14-,15+,17?,18+/m1/s1
InChIKey OIDJOYPDIKWSOW-COJCKYOVSA-N
Mol Weight 381.43 g/mol
Molecular Formula C21H23N3O4
Exact Mass 381.168856 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2V5JEo2ytBi
Name ISOMER-#2
Compound Number 5B
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H23N3O4
InChI InChI=1S/C21H23N3O4/c1-26-21(25)17(10-23)15-8-18-16-9-20-19(27-12-28-20)7-13(16)4-6-24(18)11-14(15)3-2-5-22/h7,9,14-15,17-18H,2-4,6,8,11-12H2,1H3/t14-,15+,17?,18+/m1/s1
InChIKey OIDJOYPDIKWSOW-COJCKYOVSA-N
Literature Reference Author G.DOERNYEI,C.SZANTAY,L.SZABO
Literature Reference Citation HETEROCYCLES,39,449(1994)
Literature Reference DOI 10.3987/COM-94-S(B)53
Molecular Weight 381.431 g/mol
Solvent CDCl3
Source File Reference UWCP6861
SpectraBase Batch ID Bb0Au85Uogs