| SpectraBase Spectrum ID |
LbOqb8vowPF |
| Name |
Propanamide, 2-[dihydro-2,2-dimethyl-6-(1-propenyl)furo[3,4-D]-1,3-dioxol-4(3ah)-ylidene]-N,N-diethyl-, [3as-[3A.alpha.,4E,6.alpha.(E),6A.alpha.]]- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
309.194008349 u |
| Formula |
C17H27NO4 |
| InChI |
InChI=1S/C17H27NO4/c1-7-10-12-14-15(22-17(5,6)21-14)13(20-12)11(4)16(19)18(8-2)9-3/h7,10,12,14-15H,8-9H2,1-6H3/b10-7-,13-11+/t12-,14-,15+/m0/s1 |
| InChIKey |
NPDMGTCEAGCZMK-ZYZILCJXSA-N |
| Molecular Weight |
309.406 g/mol |
| SMILES |
C(\C(=C/1[C@@]2([C@](OC(O2)(C)C)([H])[C@@](O1)(\C=C/C)[H])[H])C)(N(CC)CC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.970831 |
![Propanamide, 2-[dihydro-2,2-dimethyl-6-(1-propenyl)furo[3,4-d]-1,3-dioxol-4(3aH)-ylidene]-N,N-diethyl-, [3aS-[3a.alpha.,4E,6.alpha.(E),6a.alpha.]]-](/api/spectrum/LbOqb8vowPF/structure.png?h=300&w=458 "Propanamide, 2-[dihydro-2,2-dimethyl-6-(1-propenyl)furo[3,4-d]-1,3-dioxol-4(3aH)-ylidene]-N,N-diethyl-, [3aS-[3a.alpha.,4E,6.alpha.(E),6a.alpha.]]-")
