| SpectraBase Spectrum ID |
2uQ9BMh1ns |
| Name |
(4R,5R,E)-Ethyl 5-formyl-6-methyl-4-(nitromethyl) hept-2-enoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H19NO5 |
| InChI |
InChI=1S/C12H19NO5/c1-4-18-12(15)6-5-10(7-13(16)17)11(8-14)9(2)3/h5-6,8-11H,4,7H2,1-3H3/b6-5+/t10-,11+/m0/s1 |
| InChIKey |
YAGJQHDCSVYAKP-PFDYWKIBSA-N |
| Literature Reference DOI |
10.1002/adsc.200900879 |
| Molecular Weight |
257.286 g/mol |
| SMILES |
[C@@](C(C)C)(C=O)([C@@](\C=C\C(OCC)=O)(C[N+]([O-])=O)[H])[H] |
| SPLASH |
splash10-0ab9-8900000000-71cd4657acdc23a2adec |
| Source of Spectrum |
ASC-352-987/SM3-3d |
| Synonyms |
(4R,5R,E)-ethyl 5-formyl-6-methyl-4-(nitromethyl)hept-2-enoate |
| Wiley ID |
1764330 |
