| SpectraBase Compound ID | 7gxVwUart16 |
|---|---|
| InChI | InChI=1S/C8H10O2/c1-2-3-4-7-5-6-8(9)10-7/h2,4H,1,3,5-6H2/b7-4+ |
| InChIKey | HXJFSWBJOFJNBQ-QPJJXVBHSA-N |
| Mol Weight | 138.17 g/mol |
| Molecular Formula | C8H10O2 |
| Exact Mass | 138.06808 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Bfhs9CdTdQ5 |
|---|---|
| Name | 2(3H)-Furanone, 5-(3-butenylidene)dihydro-, (E)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 138.068079560 u |
| Formula | C8H10O2 |
| InChI | InChI=1S/C8H10O2/c1-2-3-4-7-5-6-8(9)10-7/h2,4H,1,3,5-6H2/b7-4+ |
| InChIKey | HXJFSWBJOFJNBQ-QPJJXVBHSA-N |
| Molecular Weight | 138.166 g/mol |
| SMILES | C1(O\C(CC1)=C/CC=C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.884237 |