| SpectraBase Spectrum ID |
HwH0sPCoiOZ |
| Name |
(4R,5R,E)-ethyl 5-(hydroxymethyl)-6-methyl-4-(nitromethyl) hept-2-enoate |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H21NO5 |
| InChI |
InChI=1S/C12H21NO5/c1-4-18-12(15)6-5-10(7-13(16)17)11(8-14)9(2)3/h5-6,9-11,14H,4,7-8H2,1-3H3/b6-5+/t10-,11+/m0/s1 |
| InChIKey |
BPBJQEGOBWNKJS-PFDYWKIBSA-N |
| Literature Reference DOI |
10.1002/adsc.200900879 |
| Molecular Weight |
259.302 g/mol |
| SMILES |
OC[C@](C(C)C)([C@@](\C=C\C(OCC)=O)(C[N+]([O-])=O)[H])[H] |
| SPLASH |
splash10-05mk-9400000000-d9af2f031ca347a3dc21 |
| Source of Spectrum |
ASC-352-987/SM6-9d |
| Synonyms |
(4R,5R,E)-ethyl 5-(hydroxymethyl)-6-methyl-4-(nitromethyl)hept-2-enoate |
| Wiley ID |
1764336 |
