| SpectraBase Spectrum ID |
HFEDCyqq67E |
| Name |
5-(1-Fluoro-2-methylbut-1-enyl)-dihydrofuran-2-(3H)-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
172.089957820 u |
| Formula |
C9H13FO2 |
| InChI |
InChI=1S/C9H13FO2/c1-3-6(2)9(10)7-4-5-8(11)12-7/h7H,3-5H2,1-2H3/b9-6+ |
| InChIKey |
WJZBTYTWNYXISQ-RMKNXTFCSA-N |
| Molecular Weight |
172.199 g/mol |
| SMILES |
C1(OC(CC1)\C(=C\(C)CC)F)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.954829 |
