| SpectraBase Spectrum ID |
2Ub29f7DiCq |
| Name |
(3as)-3,3A,5,7A-Tetrahydro-2H-furo[3,2-B]pyran-2-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
140.047344115 u |
| Formula |
C7H8O3 |
| InChI |
InChI=1S/C7H8O3/c8-7-4-6-5(10-7)2-1-3-9-6/h1-2,5-6H,3-4H2/t5?,6-/m0/s1 |
| InChIKey |
WCQRYYZUPNSSCS-GDVGLLTNSA-N |
| Molecular Weight |
140.138 g/mol |
| SMILES |
C1(OC2C=CCO[C@]2(C1)[H])=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.942926 |