| SpectraBase Compound ID | CXdCkKgeYjm |
|---|---|
| InChI | InChI=1S/C11H14ClNO2/c1-2-3-4-10-6-5-9(8-12)7-11(10)13(14)15/h5-7H,2-4,8H2,1H3 |
| InChIKey | MRPWSTCQLXAQLS-UHFFFAOYSA-N |
| Mol Weight | 227.69 g/mol |
| Molecular Formula | C11H14ClNO2 |
| Exact Mass | 227.071306 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LJiSsRzREB7 |
|---|---|
| Name | 1-Butyl-4-(chloromethyl)-2-nitro-benzene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H14ClNO2 |
| InChI | InChI=1S/C11H14ClNO2/c1-2-3-4-10-6-5-9(8-12)7-11(10)13(14)15/h5-7H,2-4,8H2,1H3 |
| InChIKey | MRPWSTCQLXAQLS-UHFFFAOYSA-N |
| Molecular Weight | 227.691 g/mol |
| SMILES | c1(c(ccc(c1)CCl)CCCC)N(=O)=O |
| SPLASH | splash10-03di-0590000000-df977393b01015b4879e |
| Source of Spectrum | K1-2003-3796-8 |
| Wiley ID | 1521513 |