| SpectraBase Spectrum ID |
3Jot6zqaJ8O |
| Name |
(4R,5R,E)-Ethyl 5-formyl-4-(nitromethyl) oct-2-enoate |
| Alternate Name(s) |
(4R,5R,E)-ethyl 5-formyl-4-(nitromethyl)oct-2-enoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H19NO5 |
| InChI |
InChI=1S/C12H19NO5/c1-3-5-11(9-14)10(8-13(16)17)6-7-12(15)18-4-2/h6-7,9-11H,3-5,8H2,1-2H3/b7-6+/t10-,11-/m0/s1 |
| InChIKey |
NOVXYGYWOGGATK-JYLGIWJRSA-N |
| Literature Reference DOI |
10.1002/adsc.200900879 |
| Molecular Weight |
257.286 g/mol |
| SMILES |
[C@@](CCC)(C=O)([C@@](\C=C\C(OCC)=O)(C[N+]([O-])=O)[H])[H] |
| SPLASH |
splash10-0a4i-9700000000-a90d11b032011d4c64a9 |
| Source of Spectrum |
ASC-352-987/SM3-3c |
| Wiley ID |
1764329 |
