| SpectraBase Spectrum ID |
5cucFieQG3n |
| Name |
(1S,2R,8as)-1,2-bis(Phenylmethoxy)-2,5,6,8A-tetrahydro-1H-indolizin-3-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
349.167793602 u |
| Formula |
C22H23NO3 |
| InChI |
InChI=1S/C22H23NO3/c24-22-21(26-16-18-11-5-2-6-12-18)20(19-13-7-8-14-23(19)22)25-15-17-9-3-1-4-10-17/h1-7,9-13,19-21H,8,14-16H2/t19-,20-,21+/m0/s1 |
| InChIKey |
ZICMFBCTEIBZDT-PCCBWWKXSA-N |
| Molecular Weight |
349.430 g/mol |
| SMILES |
C1(N2[C@](C=CCC2)([H])[C@@]([C@]1(OCC1=CC=CC=C1)[H])(OCC1=CC=CC=C1)[H])=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.928999 |
