| SpectraBase Spectrum ID |
3adVXnTQedY |
| Name |
(2rs,3sr,5rs)-2-Butyl-5-ethyl-3-iodotetrahydrofuran |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
282.048060231 u |
| Formula |
C10H19IO |
| InChI |
InChI=1S/C10H19IO/c1-3-5-6-10-9(11)7-8(4-2)12-10/h8-10H,3-7H2,1-2H3/t8-,9+,10-/m1/s1 |
| InChIKey |
LKIJTQBGTZMJDH-KXUCPTDWSA-N |
| Molecular Weight |
282.165 g/mol |
| SMILES |
[C@@]1(I)(C[C@@](CC)(O[C@@]1(CCCC)[H])[H])[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.919908 |
