| SpectraBase Compound ID | 6e3rrgap4jK |
|---|---|
| InChI | InChI=1S/C12H12O3/c1-9(13)7-11(14)8-12(15)10-5-3-2-4-6-10/h2-6H,7-8H2,1H3 |
| InChIKey | PWYYHTLZMQHPLP-UHFFFAOYSA-N |
| Mol Weight | 204.22 g/mol |
| Molecular Formula | C12H12O3 |
| Exact Mass | 204.078644 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6VRVbogCTyo |
|---|---|
| Name | 1,3,5-HEXANETRIONE, 1-PHENYL- |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C12H12O3 |
| InChI | InChI=1S/C12H12O3/c1-9(13)7-11(14)8-12(15)10-5-3-2-4-6-10/h2-6H,7-8H2,1H3 |
| InChIKey | PWYYHTLZMQHPLP-UHFFFAOYSA-N |
| Instrument Name | CH5 |
| Molecular Weight | 204.0783 |
| SMILES | c1cc(C(CC(CC(C)=O)=O)=O)ccc1 |
| SPLASH | splash10-0cfu-9700000000-5b07a8bad935b3754984 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |