| SpectraBase Compound ID | GhyfdfiNFAM |
|---|---|
| InChI | InChI=1S/C7H11NO3S/c9-7-2-4-12-5-6(7)1-3-8(10)11/h6H,1-5H2 |
| InChIKey | XJSUBQZJHOXVCO-UHFFFAOYSA-N |
| Mol Weight | 189.23 g/mol |
| Molecular Formula | C7H11NO3S |
| Exact Mass | 189.045964 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | ClqK313Od5o |
|---|---|
| Name | 3-(2-Nitroethyl)tetrahydro-4H-thiopyran-4-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H11NO3S |
| InChI | InChI=1S/C7H11NO3S/c9-7-2-4-12-5-6(7)1-3-8(10)11/h6H,1-5H2 |
| InChIKey | XJSUBQZJHOXVCO-UHFFFAOYSA-N |
| Molecular Weight | 189.229 g/mol |
| SMILES | C(N(=O)=O)CC1C(=O)CCSC1 |
| SPLASH | splash10-0a4r-9200000000-b40d131251460b6b4dd1 |
| Source of Spectrum | QC-8-1817-11 |
| Wiley ID | 869943 |