| SpectraBase Compound ID | 4DsjkDbUDJg |
|---|---|
| InChI | InChI=1S/C6H8O2/c1-2-5-4-7-6(3-1)8-5/h1,3,5-6H,2,4H2/t5-,6+/m1/s1 |
| InChIKey | JCJNEKWEHDYPMD-RITPCOANSA-N |
| Mol Weight | 112.13 g/mol |
| Molecular Formula | C6H8O2 |
| Exact Mass | 112.052429 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DjPAjqMxJyD |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C6H8O2 |
| InChI | InChI=1S/C6H8O2/c1-2-5-4-7-6(3-1)8-5/h1,3,5-6H,2,4H2/t5-,6+/m1/s1 |
| InChIKey | JCJNEKWEHDYPMD-RITPCOANSA-N |
| Molecular Weight | 112.0522 |
| SMILES | C1[C@@]2(O[C@@](C=CC2)(O1)[H])[H] |
| SPLASH | splash10-001i-9000000000-488338162e622b276bde |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |