| SpectraBase Compound ID | Ay7IlF5luKd |
|---|---|
| InChI | InChI=1S/C11H15FO/c1-3-11(13,4-2)9-5-7-10(12)8-6-9/h5-8,13H,3-4H2,1-2H3/i11+1 |
| InChIKey | KPTARFXLMVRLBO-KHWBWMQUSA-N |
| Mol Weight | 183.23 g/mol |
| Molecular Formula | C1013CH15FO |
| Exact Mass | 183.114048 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7004iIAUG3m |
|---|---|
| Name | 3-(4-fluorophenyl)pentan-3-ol-3-(13)C |
| Comments | Original formula: C10[13C]H15FO |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H15FO |
| InChI | InChI=1S/C11H15FO/c1-3-11(13,4-2)9-5-7-10(12)8-6-9/h5-8,13H,3-4H2,1-2H3/i11+1 |
| InChIKey | KPTARFXLMVRLBO-KHWBWMQUSA-N |
| Molecular Weight | 183.231 g/mol |
| SMILES | O[13C](c1ccc(cc1)F)(CC)CC |
| SPLASH | splash10-0udi-0900000000-caa48bf54a45c1f5f318 |
| Source of Spectrum | J-55-4558-0 |
| Wiley ID | 1178607 |