| SpectraBase Spectrum ID |
HFIkdfiJNMW |
| Name |
6-Heptenoic acid, 5-oxo-7-(3-propyloxiranyl)-, methyl ester, [2S-[2.alpha.(E),3.beta.]]- |
| CAS Registry Number |
115065-96-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H20O4 |
| InChI |
InChI=1S/C13H20O4/c1-3-5-11-12(17-11)9-8-10(14)6-4-7-13(15)16-2/h8-9,11-12H,3-7H2,1-2H3/b9-8+/t11-,12-/m0/s1 |
| InChIKey |
YESWTEBNFZERRS-OMJLJAAMSA-N |
| Molecular Weight |
240.299 g/mol |
| SMILES |
[C@@]1(O[C@]1(CCC)[H])(\C=C\C(=O)CCCC(=O)OC)[H] |
| SPLASH |
splash10-001i-9720000000-1b7616f402a64aab05be |
| Source of Spectrum |
F-43-4262-8 |
| Synonyms |
Methyl (6E)-5-oxo-7-[(2S,3S)-3-propyloxiranyl]-6-heptenoate
Methyl 8,9(S,S)-epoxy-5-oxo-dodec-6-enoate
Methyl-8,9-(S,S)-epoxy-5-oxo-6-dodecenoate |
| Wiley ID |
1242856 |
![6-Heptenoic acid, 5-oxo-7-(3-propyloxiranyl)-, methyl ester, [2S-[2.alpha.(E),3.beta.]]-](/api/spectrum/HFIkdfiJNMW/structure.png?h=300&w=458 "6-Heptenoic acid, 5-oxo-7-(3-propyloxiranyl)-, methyl ester, [2S-[2.alpha.(E),3.beta.]]-")
