| SpectraBase Compound ID | H3q27PMnUP0 |
|---|---|
| InChI | InChI=1S/C12H13NO2/c1-2-3-4-5-6-11-7-9-12(10-8-11)13(14)15/h7-10H,2-4H2,1H3 |
| InChIKey | BILXKRUVEDBOQQ-UHFFFAOYSA-N |
| Mol Weight | 203.24 g/mol |
| Molecular Formula | C12H13NO2 |
| Exact Mass | 203.094629 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1xxQIHwHn3X |
|---|---|
| Name | 1-(Hex-1'-yn-1'-yl)-4-nitrobenzene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H13NO2 |
| InChI | InChI=1S/C12H13NO2/c1-2-3-4-5-6-11-7-9-12(10-8-11)13(14)15/h7-10H,2-4H2,1H3 |
| InChIKey | BILXKRUVEDBOQQ-UHFFFAOYSA-N |
| Molecular Weight | 203.241 g/mol |
| SMILES | c1(N(=O)=O)ccc(C#CCCCC)cc1 |
| SPLASH | splash10-0f9l-0910000000-cbf69bed69416cca3997 |
| Source of Spectrum | H-92-901-H |
| Synonyms | 1-Hex-1-ynyl-4-nitrobenzene |
| Wiley ID | 1693787 |