| SpectraBase Compound ID | A72iZNtbr3o |
|---|---|
| InChI | InChI=1S/C8H12ClNO3S/c1-3-7-6(4-9)5-10(8(7)11)14(2,12)13/h3-5H2,1-2H3 |
| InChIKey | BUBQRJRJEWTNLB-UHFFFAOYSA-N |
| Mol Weight | 237.7 g/mol |
| Molecular Formula | C8H12ClNO3S |
| Exact Mass | 237.022642 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | COHra7JyoYu |
|---|---|
| Name | 4-(Chloromethyl)-3-ethyl-1-(methylsulfonyl)-1H-pyrrol-2(5H)-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H12ClNO3S |
| InChI | InChI=1S/C8H12ClNO3S/c1-3-7-6(4-9)5-10(8(7)11)14(2,12)13/h3-5H2,1-2H3 |
| InChIKey | BUBQRJRJEWTNLB-UHFFFAOYSA-N |
| Molecular Weight | 237.701 g/mol |
| SMILES | CS(N1C(C(CC)=C(C1)CCl)=O)(=O)=O |
| SPLASH | splash10-0a70-2960000000-3dab54d10f9575b9af9c |
| Source of Spectrum | F4-43-1275-3c |
| Wiley ID | 1675625 |