| SpectraBase Spectrum ID |
KlpGyqfelht |
| Name |
Trans-1-[(Z)-4-chlorobut-3-en-1-ynyl]-2-ethoxycyclopropane |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
170.049842673 u |
| Formula |
C9H11ClO |
| InChI |
InChI=1S/C9H11ClO/c1-2-11-9-7-8(9)5-3-4-6-10/h4,6,8-9H,2,7H2,1H3/b6-4-/t8-,9-/m1/s1 |
| InChIKey |
DKBGCITUNFMURY-FXFQRMSGSA-N |
| Molecular Weight |
170.639 g/mol |
| SMILES |
[C@@]1(C[C@]1(OCC)[H])(C#C\C=C/Cl)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.974201 |
![Trans-1-[(Z)-4-chlorobut-3-en-1-ynyl]-2-ethoxycyclopropane](/api/spectrum/KlpGyqfelht/structure.png?h=300&w=458 "Trans-1-[(Z)-4-chlorobut-3-en-1-ynyl]-2-ethoxycyclopropane")
