| SpectraBase Spectrum ID |
IsPb6zcPso1 |
| Name |
Trans-methyl 2-pentyl-5-oxo-tetrahydro-3-furancarboxylate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
214.120509056 u |
| Formula |
C11H18O4 |
| InChI |
InChI=1S/C11H18O4/c1-3-4-5-6-9-8(11(13)14-2)7-10(12)15-9/h8-9H,3-7H2,1-2H3/t8-,9+/m1/s1 |
| InChIKey |
DUZVSHOYOGVYRV-BDAKNGLRSA-N |
| Molecular Weight |
214.261 g/mol |
| SMILES |
[C@]1([C@@](OC(C1)=O)(CCCCC)[H])(C(=O)OC)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.931651 |
