| SpectraBase Spectrum ID |
BsuRaEXgEzI |
| Name |
(4R,5R)-4-Methoxymethoxy-5-phthalimidohexanal |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
305.126322711 u |
| Formula |
C16H19NO5 |
| InChI |
InChI=1S/C16H19NO5/c1-11(14(8-5-9-18)22-10-21-2)17-15(19)12-6-3-4-7-13(12)16(17)20/h3-4,6-7,9,11,14H,5,8,10H2,1-2H3/t11-,14-/m1/s1 |
| InChIKey |
WZYFEFFGUXZZFV-BXUZGUMPSA-N |
| Molecular Weight |
305.330 g/mol |
| SMILES |
C1(N(C(C2=CC=CC=C12)=O)[C@@]([C@](OCOC)(CCC=O)[H])(C)[H])=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.937099 |
