| SpectraBase Compound ID | 1o3cvtYiFC |
|---|---|
| InChI | InChI=1S/C12H18Cl3NO/c1-9(2)5-4-6-10(3)7-8-16-11(17)12(13,14)15/h5,7H,4,6,8H2,1-3H3,(H,16,17)/b10-7+ |
| InChIKey | IEBYVCFNVKHCAH-JXMROGBWSA-N |
| Mol Weight | 298.64 g/mol |
| Molecular Formula | C12H18Cl3NO |
| Exact Mass | 297.045397 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3sZPLdLCzhn |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C12H18NOCl3 |
| InChI | InChI=1S/C12H18Cl3NO/c1-9(2)5-4-6-10(3)7-8-16-11(17)12(13,14)15/h5,7H,4,6,8H2,1-3H3,(H,16,17)/b10-7+ |
| InChIKey | IEBYVCFNVKHCAH-JXMROGBWSA-N |
| Molecular Weight | 297.0451 |
| SMILES | N(C(C(Cl)(Cl)Cl)=O)C\C=C/(C)CCC=C(C)C |
| SPLASH | splash10-014l-9200000000-d69df5f5855537a3916c |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |