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Benzeneethanamine, 4-hydroxy-3-methoxy-N-[3-benzyloxy-4-methoxybenzoyl]
SpectraBase Compound ID Lc5gemDrKG4
InChI InChI=1S/C24H25NO5/c1-28-21-11-9-19(15-23(21)30-16-18-6-4-3-5-7-18)24(27)25-13-12-17-8-10-20(26)22(14-17)29-2/h3-11,14-15,26H,12-13,16H2,1-2H3,(H,25,27)
InChIKey QVTTZOCSWQZAGM-UHFFFAOYSA-N
Mol Weight 407.47 g/mol
Molecular Formula C24H25NO5
Exact Mass 407.173273 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8uEKPGOB8Q0
Name Benzeneethanamine, 4-hydroxy-3-methoxy-N-[3-benzyloxy-4-methoxybenzoyl]
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 407.173272904 u
Formula C24H25NO5
InChI InChI=1S/C24H25NO5/c1-28-21-11-9-19(15-23(21)30-16-18-6-4-3-5-7-18)24(27)25-13-12-17-8-10-20(26)22(14-17)29-2/h3-11,14-15,26H,12-13,16H2,1-2H3,(H,25,27)
InChIKey QVTTZOCSWQZAGM-UHFFFAOYSA-N
Molecular Weight 407.466 g/mol
SMILES C1(=CC(=CC=C1OC)C(NCCC1=CC=C(O)C(=C1)OC)=O)OCC1=CC=CC=C1