| SpectraBase Spectrum ID |
3zRckWELhLR |
| Name |
4-Hexenoic acid, 2-acetyl-6-(nitrooxy)-, ethyl ester, (E)- |
| CAS Registry Number |
100432-02-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C10H15NO6 |
| InChI |
InChI=1S/C10H15NO6/c1-3-16-10(13)9(8(2)12)6-4-5-7-17-11(14)15/h4-5,9H,3,6-7H2,1-2H3/b5-4+ |
| InChIKey |
AAOUHJUUTQZKBW-SNAWJCMRSA-N |
| Molecular Weight |
245.231 g/mol |
| SMILES |
C(ON(=O)=O)\C=C\CC(C(=O)OCC)C(=O)C |
| SPLASH |
splash10-0006-9100000000-2e66adbbd6b67894b1aa |
| Source of Spectrum |
J-51-1648-8 |
| Synonyms |
5-Carbethoxy-6-oxo-2(E)-hepten-1-ol nitrate
Ethyl (4E)-2-acetyl-6-(nitrooxy)-4-hexenoate |
| Wiley ID |
1247777 |
