| SpectraBase Spectrum ID |
16xiAH0xVWt |
| Name |
Oxiranecarboxaldehyde, 3-(4-hexenyl)-, [2.alpha.,3.beta.(E)]- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
154.099379689 u |
| Formula |
C9H14O2 |
| InChI |
InChI=1S/C9H14O2/c1-2-3-4-5-6-8-9(7-10)11-8/h2-3,7-9H,4-6H2,1H3/b3-2+/t8-,9-/m1/s1 |
| InChIKey |
MZJNFLAKCUAZRH-KHVQUVQLSA-N |
| Molecular Weight |
154.209 g/mol |
| SMILES |
[C@]1(O[C@@]1(CCC\C=C\C)[H])(C=O)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.962842 |
![Oxiranecarboxaldehyde, 3-(4-hexenyl)-, [2.alpha.,3.beta.(E)]-](/api/spectrum/16xiAH0xVWt/structure.png?h=300&w=458 "Oxiranecarboxaldehyde, 3-(4-hexenyl)-, [2.alpha.,3.beta.(E)]-")
