| SpectraBase Compound ID | FqyZuRAyjfa |
|---|---|
| InChI | InChI=1S/C9H15NO4/c11-6-9(10(13)14)7-3-1-2-4-8(12)5-7/h7,9,11H,1-6H2/t7-,9?/m0/s1 |
| InChIKey | CAHSDSRLPFKANE-JAVCKPHESA-N |
| Mol Weight | 201.22 g/mol |
| Molecular Formula | C9H15NO4 |
| Exact Mass | 201.100108 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Asbqjz5MNU1 |
|---|---|
| Name | (3S)-3-(2-Hydroxy-1-nitroethyl)cycloheptanone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H15NO4 |
| InChI | InChI=1S/C9H15NO4/c11-6-9(10(13)14)7-3-1-2-4-8(12)5-7/h7,9,11H,1-6H2/t7-,9?/m0/s1 |
| InChIKey | CAHSDSRLPFKANE-JAVCKPHESA-N |
| Molecular Weight | 201.222 g/mol |
| SMILES | OCC(N(=O)=O)[C@@]1(CC(=O)CCCC1)[H] |
| SPLASH | splash10-08fr-0900000000-40ae412adfd9717f6d10 |
| Source of Spectrum | F-53-11231-0 |
| Wiley ID | 803304 |