| SpectraBase Compound ID | AdiHPxhD1Hx |
|---|---|
| InChI | InChI=1S/C9H5NO3/c1-2-7-5-9(10(12)13)4-3-8(7)6-11/h1,3-6H |
| InChIKey | VNECNBHFFDSARI-UHFFFAOYSA-N |
| Mol Weight | 175.14 g/mol |
| Molecular Formula | C9H5NO3 |
| Exact Mass | 175.026943 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JwmpzZ6wtvP |
|---|---|
| Name | 2-Ethynyl-4-nitrobenzaldehyde |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H5NO3 |
| InChI | InChI=1S/C9H5NO3/c1-2-7-5-9(10(12)13)4-3-8(7)6-11/h1,3-6H |
| InChIKey | VNECNBHFFDSARI-UHFFFAOYSA-N |
| Molecular Weight | 175.143 g/mol |
| SMILES | C(c1c(cc(cc1)N(=O)=O)C#C)=O |
| SPLASH | splash10-004i-5900000000-77902eeb4bcb11cda9b8 |
| Source of Spectrum | U-1996-455-12 |
| Wiley ID | 768338 |