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2-(Benzyloxycarbonyl)aminomethyl-7-(t-butoxycarbonylaminomethyl)naphthalene
SpectraBase Compound ID IyMHroF8DJO
InChI InChI=1S/C25H28N2O4/c1-25(2,3)31-24(29)27-16-20-10-12-21-11-9-19(13-22(21)14-20)15-26-23(28)30-17-18-7-5-4-6-8-18/h4-14H,15-17H2,1-3H3,(H,26,28)(H,27,29)
InChIKey FSXXMJFXDFHSCA-UHFFFAOYSA-N
Mol Weight 420.51 g/mol
Molecular Formula C25H28N2O4
Exact Mass 420.204907 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AOV7xy7dnhn
Name 2-(Benzyloxycarbonyl)aminomethyl-7-(T-butoxycarbonylaminomethyl)naphthalene
Comments Computed using HOSE algorithm
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Exact Mass 420.204907386 u
Formula C25H28N2O4
InChI InChI=1S/C25H28N2O4/c1-25(2,3)31-24(29)27-16-20-10-12-21-11-9-19(13-22(21)14-20)15-26-23(28)30-17-18-7-5-4-6-8-18/h4-14H,15-17H2,1-3H3,(H,26,28)(H,27,29)
InChIKey FSXXMJFXDFHSCA-UHFFFAOYSA-N
Molecular Weight 420.509 g/mol
SMILES C(NCC1=CC2=CC(CNC(=O)OCC=3C=CC=CC3)=CC=C2C=C1)(OC(C)(C)C)=O