| SpectraBase Compound ID | DNabyLiRvJW |
|---|---|
| InChI | InChI=1S/C9H13NO2/c1-3-9(4-2)7(11)5-6-10-8(9)12/h5-6H,3-4H2,1-2H3,(H,10,12) |
| InChIKey | NZASCBIBXNPDMH-UHFFFAOYSA-N |
| Mol Weight | 167.21 g/mol |
| Molecular Formula | C9H13NO2 |
| Exact Mass | 167.094629 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2pbEESAFFg4 |
|---|---|
| Name | PYRITHYLDIONE |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H13NO2 |
| InChI | InChI=1S/C9H13NO2/c1-3-9(4-2)7(11)5-6-10-8(9)12/h5-6H,3-4H2,1-2H3,(H,10,12) |
| InChIKey | NZASCBIBXNPDMH-UHFFFAOYSA-N |
| Instrument Name | GC |
| Molecular Weight | 167.208 g/mol |
| SMILES | N1C(C(C(C=C1)=O)(CC)CC)=O |
| SPLASH | splash10-05ad-9200000000-d69016143419b37704e7 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |