| SpectraBase Compound ID | 2LP94Y6EXUx |
|---|---|
| InChI | InChI=1S/C12H14N2O7/c1-3-4-5-21-12-8(7-15)11(14(18)19)10(20-2)6-9(12)13(16)17/h6-7H,3-5H2,1-2H3 |
| InChIKey | WCOUWLBBBKIEKG-UHFFFAOYSA-N |
| Mol Weight | 298.25 g/mol |
| Molecular Formula | C12H14N2O7 |
| Exact Mass | 298.080101 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | C8WihX5FQu1 |
|---|---|
| Name | 2-Butoxy-5-methoxy-3,6-dinitrobenzaldehyde |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H14N2O7 |
| InChI | InChI=1S/C12H14N2O7/c1-3-4-5-21-12-8(7-15)11(14(18)19)10(20-2)6-9(12)13(16)17/h6-7H,3-5H2,1-2H3 |
| InChIKey | WCOUWLBBBKIEKG-UHFFFAOYSA-N |
| Molecular Weight | 298.251 g/mol |
| SMILES | C(c1c(c(cc(c1N(=O)=O)OC)N(=O)=O)OCCCC)=O |
| SPLASH | splash10-0595-2090000000-e08e566891e187fc702c |
| Source of Spectrum | H-86-1998-5 |
| Wiley ID | 1525488 |