| SpectraBase Compound ID | CVUbobqZDbD |
|---|---|
| InChI | InChI=1S/C13H10O/c14-13-10-6-2-5-9-12(13)11-7-3-1-4-8-11/h1-10H |
| InChIKey | UDHQYCHTORTPRF-UHFFFAOYSA-N |
| Mol Weight | 182.22 g/mol |
| Molecular Formula | C13H10O |
| Exact Mass | 182.073165 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1R4A5jM6YLT |
|---|---|
| Name | 2,4,6-CYCLOHEPTATRIEN-1-ONE, 2-PHENYL- |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C13H10O |
| InChI | InChI=1S/C13H10O/c14-13-10-6-2-5-9-12(13)11-7-3-1-4-8-11/h1-10H |
| InChIKey | UDHQYCHTORTPRF-UHFFFAOYSA-N |
| Molecular Weight | 182.0729 |
| SMILES | C1(=O)C(c2ccccc2)=CC=CC=C1 |
| SPLASH | splash10-0f89-3900000000-97df4a8324b0c893bb1a |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |