| SpectraBase Compound ID | 8dSCrmBgsRl |
|---|---|
| InChI | InChI=1S/C7H9NO/c1-5-3-8-7(4-9)6(5)2/h3-4,8H,1-2H3 |
| InChIKey | LRJDGBKOYYAJJF-UHFFFAOYSA-N |
| Mol Weight | 123.15 g/mol |
| Molecular Formula | C7H9NO |
| Exact Mass | 123.068414 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9kn4gkGRfK |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H9NO |
| InChI | InChI=1S/C7H9NO/c1-5-3-8-7(4-9)6(5)2/h3-4,8H,1-2H3 |
| InChIKey | LRJDGBKOYYAJJF-UHFFFAOYSA-N |
| Molecular Weight | 123.0682 |
| SMILES | [nH]1c(c(c(c1)C)C)C=O |
| SPLASH | splash10-00di-6900000000-1fe055b3acb7d7258a05 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |