| SpectraBase Spectrum ID |
H3Re6RT7qoO |
| Name |
2-Furanpropanoic acid, tetrahydro-.alpha.,5,5-trimethyl-, methyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
200.141244501 u |
| Formula |
C11H20O3 |
| InChI |
InChI=1S/C11H20O3/c1-8(10(12)13-4)7-9-5-6-11(2,3)14-9/h8-9H,5-7H2,1-4H3 |
| InChIKey |
HUFICZMEAMDFTK-UHFFFAOYSA-N |
| Molecular Weight |
200.278 g/mol |
| SMILES |
C(C(CC1OC(C)(C)CC1)C)(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.980132 |
