SpectraBase Spectrum ID |
GaQDuRHhvNP |
Name |
2-(2-[4-(Benzyloxy)phenyl]ethyl)hexahydro-2H-isoxazolo[2,3-A]pyridine |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
337.204179111 u |
Formula |
C22H27NO2 |
InChI |
InChI=1S/C22H27NO2/c1-2-6-19(7-3-1)17-24-21-12-9-18(10-13-21)11-14-22-16-20-8-4-5-15-23(20)25-22/h1-3,6-7,9-10,12-13,20,22H,4-5,8,11,14-17H2/t20-,22-/m1/s1 |
InChIKey |
FVQXZDIUKOZKIN-IFMALSPDSA-N |
Molecular Weight |
337.463 g/mol |
SMILES |
[C@]12(N(O[C@@](C2)(CCC2=CC=C(OCC3=CC=CC=C3)C=C2)[H])CCCC1)[H] |