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Eserine, 2'-benzylaminocarbonyl-

View entire compound with spectra: 1 NMR

Eserine, 2'-benzylaminocarbonyl-
SpectraBase Compound ID 5CujIZq37mP
InChI InChI=1S/C23H28N4O3/c1-23-12-13-25(2)20(23)26(3)19-11-10-17(14-18(19)23)30-22(29)27(4)21(28)24-15-16-8-6-5-7-9-16/h5-11,14,20H,12-13,15H2,1-4H3,(H,24,28)
InChIKey YFILXGYPMFAIER-UHFFFAOYSA-N
Mol Weight 408.5 g/mol
Molecular Formula C23H28N4O3
Exact Mass 408.216141 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L58eFjBzkBm
Name Eserine, 2'-benzylaminocarbonyl-
Comments Computed using HOSE algorithm
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Exact Mass 408.216140775 u
Formula C23H28N4O3
InChI InChI=1S/C23H28N4O3/c1-23-12-13-25(2)20(23)26(3)19-11-10-17(14-18(19)23)30-22(29)27(4)21(28)24-15-16-8-6-5-7-9-16/h5-11,14,20H,12-13,15H2,1-4H3,(H,24,28)
InChIKey YFILXGYPMFAIER-UHFFFAOYSA-N
Molecular Weight 408.502 g/mol
SMILES C1=C(C=CC2=C1C1(CCN(C1N2C)C)C)OC(=O)N(C)C(NCC1=CC=CC=C1)=O