| SpectraBase Compound ID | CJKQMiuqKB |
|---|---|
| InChI | InChI=1S/C8H6ClNO3/c9-5-8(11)6-2-1-3-7(4-6)10(12)13/h1-4H,5H2 |
| InChIKey | LBHUVZXFCGZYDL-UHFFFAOYSA-N |
| Mol Weight | 199.59 g/mol |
| Molecular Formula | C8H6ClNO3 |
| Exact Mass | 199.003621 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 86H2zbDIhDm |
|---|---|
| Name | omega-CHLORO-3-NITROACETOPHENONE |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C8H6ClNO3 |
| InChI | InChI=1S/C8H6ClNO3/c9-5-8(11)6-2-1-3-7(4-6)10(12)13/h1-4H,5H2 |
| InChIKey | LBHUVZXFCGZYDL-UHFFFAOYSA-N |
| Molecular Weight | 199.0035 |
| SMILES | c1c(N(=O)=O)cc(C(CCl)=O)cc1 |
| SPLASH | splash10-0udi-7900000000-eef9fe23f35836b33831 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |