| SpectraBase Compound ID | AfFmu42poAk |
|---|---|
| InChI | InChI=1S/C9H12O3/c10-9(11)7-3-1-2-6-4-5-12-8(6)7/h6H,1-5H2,(H,10,11) |
| InChIKey | NNJDGUJQKANQMG-UHFFFAOYSA-N |
| Mol Weight | 168.19 g/mol |
| Molecular Formula | C9H12O3 |
| Exact Mass | 168.078644 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EQkjFzqoxdX |
|---|---|
| Name | 2,3,3a,4,5,6-hexahydro-1-benzofuran-7-carboxylic acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H12O3 |
| InChI | InChI=1S/C9H12O3/c10-9(11)7-3-1-2-6-4-5-12-8(6)7/h6H,1-5H2,(H,10,11) |
| InChIKey | NNJDGUJQKANQMG-UHFFFAOYSA-N |
| Molecular Weight | 168.192 g/mol |
| SMILES | OC(C1=C2OCCC2CCC1)=O |
| SPLASH | splash10-0udi-2900000000-fd9ba4df715ebbc9aa02 |
| Source of Spectrum | QC-17-898-9 |
| Wiley ID | 1638158 |