| SpectraBase Spectrum ID |
EOzMJvlqH3y |
| Name |
Methyl 6-[N-(benzyloxycarbonl)-N-formylamino]hexen-2-oate |
| 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/c1-21-15(19)10-6-3-7-11-17(13-18)16(20)22-12-14-8-4-2-5-9-14/h2,4-6,8-10,13H,3,7,11-12H2,1H3/b10-6+ |
| InChIKey |
DCIYTTNUBRTMMA-UXBLZVDNSA-N |
| Molecular Weight |
305.330 g/mol |
| SMILES |
C(N(C=O)CCC\C=C\C(=O)OC)(OCC1=CC=CC=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.977833 |
![Methyl 6-[N-(benzyloxycarbonl)-N-formylamino]hexen-2-oate](/api/spectrum/EOzMJvlqH3y/structure.png?h=300&w=458 "Methyl 6-[N-(benzyloxycarbonl)-N-formylamino]hexen-2-oate")
