| SpectraBase Compound ID | 1JRs2xwAhA3 |
|---|---|
| InChI | InChI=1S/C8H6O2/c9-8-7-4-2-1-3-6(7)5-10-8/h1-4H,5H2 |
| InChIKey | WNZQDUSMALZDQF-UHFFFAOYSA-N |
| Mol Weight | 134.13 g/mol |
| Molecular Formula | C8H6O2 |
| Exact Mass | 134.036779 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JXK54I81fBp |
|---|---|
| Name | 1(3H)-ISOBENZOFURANONE |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C8H6O2 |
| InChI | InChI=1S/C8H6O2/c9-8-7-4-2-1-3-6(7)5-10-8/h1-4H,5H2 |
| InChIKey | WNZQDUSMALZDQF-UHFFFAOYSA-N |
| Molecular Weight | 134.0366 |
| SMILES | c1ccc2C(=O)OCc2c1 |
| SPLASH | splash10-0a6r-9800000000-df8b286ede7d0a9e293b |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |