| SpectraBase Compound ID | 7LmN7hOLHHi |
|---|---|
| InChI | InChI=1S/C8H8O2/c1-10-8-6-4-2-3-5-7(8)9/h2-6H,1H3/i3D |
| InChIKey | IQYJSKNHDZZDGA-WFVSFCRTSA-N |
| Mol Weight | 137.16 g/mol |
| Molecular Formula | C8H72HO2 |
| Exact Mass | 137.058706 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3dQRKNp0SW |
|---|---|
| Name | 2-Methoxy(6-D)cyclohepta-2,4,6-trien-1-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H7DO2 |
| InChI | InChI=1S/C8H8O2/c1-10-8-6-4-2-3-5-7(8)9/h2-6H,1H3/i3D |
| InChIKey | IQYJSKNHDZZDGA-WFVSFCRTSA-N |
| Molecular Weight | 137.156 g/mol |
| SMILES | C=1C(C(=CC=CC1[D])OC)=O |
| SPLASH | splash10-0a4i-4900000000-3de34a56ad39c7ec3811 |
| Source of Spectrum | B-50-406-32 |
| Synonyms | 2-Methoxy-6-deuteriocyclohepta-2,4,6-trien-1-one |
| Wiley ID | 745548 |