| SpectraBase Compound ID | 8SKVv6D8HfH |
|---|---|
| InChI | InChI=1S/C17H7Cl2NO2/c18-14-15(19)17(22)13(12(8-20)16(14)21)11-7-6-9-4-2-1-3-5-10(9)11/h1-7H |
| InChIKey | BYNVDQADXAVMIC-UHFFFAOYSA-N |
| Mol Weight | 328.15 g/mol |
| Molecular Formula | C17H7Cl2NO2 |
| Exact Mass | 326.985384 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7MuX25J9pCy |
|---|---|
| Name | 1-Azulen-1-yl-2-cyano-4,5-dichloro-para-quinone |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C17H7Cl2NO2 |
| InChI | InChI=1S/C17H7Cl2NO2/c18-14-15(19)17(22)13(12(8-20)16(14)21)11-7-6-9-4-2-1-3-5-10(9)11/h1-7H |
| InChIKey | BYNVDQADXAVMIC-UHFFFAOYSA-N |
| Molecular Weight | 328.154 g/mol |
| SMILES | C1(=C(C(=O)C(=C(C1=O)Cl)Cl)C#N)c1c2c(ccccc2)cc1 |
| SPLASH | splash10-004i-0009000000-20f28b52d8da89a50f7e |
| Source of Spectrum | CV-2002-2519-2 |
| Synonyms | 2-(1-azulenyl)-4,5-dichloro-3,6-dioxo-1,4-cyclohexadiene-1-carbonitrile 2-Azulen-1-yl-4,5-dichloro-3,6-dioxo-cyclohexa-1,4-dienecarbonitrile 2-Azulen-1-yl-3-cyano-5,6-dichloro-para-quinone 2-(1-azulenyl)-4,5-dichloro-3,6-dioxo-1-cyclohexa-1,4-dienecarbonitrile 2-azulen-1-yl-4,5-dichloro-3,6-dioxocyclohexa-1,4-diene-1-carbonitrile 2-azulen-1-yl-4,5-dichloro-3,6-dioxo-cyclohexa-1,4-diene-1-carbonitrile 2-azulen-1-yl-4,5-bis(chloranyl)-3,6-bis(oxidanylidene)cyclohexa-1,4-diene-1-carbonitrile |
| Wiley ID | 1610585 |