| SpectraBase Spectrum ID |
G62egtK17fB |
| Name |
2-Hexyn-1-one, 1-(tetrahydro-3-furanyl)-, (R)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
166.099379689 u |
| Formula |
C10H14O2 |
| InChI |
InChI=1S/C10H14O2/c1-2-3-4-5-10(11)9-6-7-12-8-9/h9H,2-3,6-8H2,1H3/t9-/m1/s1 |
| InChIKey |
VFRZFTSTMWTZLX-SECBINFHSA-N |
| Molecular Weight |
166.220 g/mol |
| SMILES |
C(#CCCC)C([C@]1(COCC1)[H])=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.840896 |
