| SpectraBase Compound ID | C2lSrjG6AH0 |
|---|---|
| InChI | InChI=1S/C9H12O2/c10-9-5-7-3-1-2-4-8(7)6-11-9/h2,4,7-8H,1,3,5-6H2 |
| InChIKey | SFBHBRZCFVNDRV-UHFFFAOYSA-N |
| Mol Weight | 152.19 g/mol |
| Molecular Formula | C9H12O2 |
| Exact Mass | 152.08373 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | KyJG1UtLP5E |
|---|---|
| Name | 1,4,4a,5,6,8a-Hexahydroisochromen-3-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H12O2 |
| InChI | InChI=1S/C9H12O2/c10-9-5-7-3-1-2-4-8(7)6-11-9/h2,4,7-8H,1,3,5-6H2 |
| InChIKey | SFBHBRZCFVNDRV-UHFFFAOYSA-N |
| Molecular Weight | 152.193 g/mol |
| SMILES | C1(OCC2C(C1)CCC=C2)=O |
| SPLASH | splash10-001i-9800000000-0e3f60cac4f31dc8fe36 |
| Source of Spectrum | QB-14-452-9 |
| Synonyms | 1,4,4a,5,6,8a-hexahydro-3H-2-benzopyran-3-one |
| Wiley ID | 841331 |