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Benzeneethanamine, 3,5-benzyloxy-N-ethoxycarbonyl-

View entire compound with spectra: 1 NMR

Benzeneethanamine, 3,5-benzyloxy-N-ethoxycarbonyl-
SpectraBase Compound ID FKZVMeyeXQB
InChI InChI=1S/C25H27NO4/c1-2-28-25(27)26-14-13-22-15-23(29-18-20-9-5-3-6-10-20)17-24(16-22)30-19-21-11-7-4-8-12-21/h3-12,15-17H,2,13-14,18-19H2,1H3,(H,26,27)
InChIKey HUHNXKLXNUBAAK-UHFFFAOYSA-N
Mol Weight 405.49 g/mol
Molecular Formula C25H27NO4
Exact Mass 405.194008 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DnUTA5ti0xA
Name Benzeneethanamine, 3,5-benzyloxy-N-ethoxycarbonyl-
Comments Computed using HOSE algorithm
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Exact Mass 405.194008349 u
Formula C25H27NO4
InChI InChI=1S/C25H27NO4/c1-2-28-25(27)26-14-13-22-15-23(29-18-20-9-5-3-6-10-20)17-24(16-22)30-19-21-11-7-4-8-12-21/h3-12,15-17H,2,13-14,18-19H2,1H3,(H,26,27)
InChIKey HUHNXKLXNUBAAK-UHFFFAOYSA-N
Molecular Weight 405.494 g/mol
SMILES C1=C(C=C(C=C1OCC1=CC=CC=C1)OCC1=CC=CC=C1)CCNC(OCC)=O