| SpectraBase Compound ID | 6WKQL1pbTWY |
|---|---|
| InChI | InChI=1S/C9H14Cl3NO/c1-3-4-6-13(2)7-5-8(14)9(10,11)12/h5,7H,3-4,6H2,1-2H3/b7-5+ |
| InChIKey | YVGDNNYRKKCXMX-FNORWQNLSA-N |
| Mol Weight | 258.58 g/mol |
| Molecular Formula | C9H14Cl3NO |
| Exact Mass | 257.014097 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BXOILyfsgsl |
|---|---|
| Name | (E)-4-(Butylmethylamino)-1,1,1-trichloro-3-buten-2-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H14Cl3NO |
| InChI | InChI=1S/C9H14Cl3NO/c1-3-4-6-13(2)7-5-8(14)9(10,11)12/h5,7H,3-4,6H2,1-2H3/b7-5+ |
| InChIKey | YVGDNNYRKKCXMX-FNORWQNLSA-N |
| Molecular Weight | 258.576 g/mol |
| SMILES | C(C(\C=C\N(CCCC)C)=O)(Cl)(Cl)Cl |
| SPLASH | splash10-052f-3950000000-1929dc0523c48b55a741 |
| Source of Spectrum | AH-139-1326-12c |
| Wiley ID | 1714112 |