| SpectraBase Spectrum ID |
COCHIZCyccP |
| Name |
(E)-5-Butyl-2'-oxotetrahydro[2,3']-bifuranylidene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
210.125594437 u |
| Formula |
C12H18O3 |
| InChI |
InChI=1S/C12H18O3/c1-2-3-4-9-5-6-11(15-9)10-7-8-14-12(10)13/h9H,2-8H2,1H3/b11-10+ |
| InChIKey |
VCNDKZPYMMJFAP-ZHACJKMWSA-N |
| Molecular Weight |
210.273 g/mol |
| SMILES |
C1(O\C(=C\2C(OCC2)=O)CC1)CCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.969747 |
![(E)-5-Butyl-2'-oxotetrahydro[2,3']-bifuranylidene](/api/spectrum/COCHIZCyccP/structure.png?h=300&w=458 "(E)-5-Butyl-2'-oxotetrahydro[2,3']-bifuranylidene")
