SpectraBase Spectrum ID |
LOPdZGq0CIH |
Name |
(10Ar)-6-oxodecahydro-7,10-methanopyrido[1,2-A]azepin-9-yl 4-phenylpiperidine-1-carboxylate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
382.225642831 u |
Formula |
C23H30N2O3 |
InChI |
InChI=1S/C23H30N2O3/c26-22-18-14-19(20-8-4-5-11-25(20)22)21(15-18)28-23(27)24-12-9-17(10-13-24)16-6-2-1-3-7-16/h1-3,6-7,17-21H,4-5,8-15H2/t18?,19?,20-,21?/m1/s1 |
InChIKey |
MORCQQHPUGUOSQ-WTLQVUHWSA-N |
Molecular Weight |
382.504 g/mol |
SMILES |
C1N(CCC(C1)C1=CC=CC=C1)C(=O)OC1CC2C(N3[C@@](C1C2)(CCCC3)[H])=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.922128 |