| SpectraBase Compound ID | FTKW6ujAKfI |
|---|---|
| InChI | InChI=1S/6C17H21NO3/c1-12-15(20)10-14(19)11-17(12)21-16(8-9-18-2)13-6-4-3-5-7-13;1-12-10-14(19)15(20)11-17(12)21-16(8-9-18-2)13-6-4-3-5-7-13;1-12-10-14(19)11-15(20)17(12)21-16(8-9-18-2)13-6-4-3-5-7-13;1-12-15(9-8-14(19)17(12)20)21-16(10-11-18-2)13-6-4-3-5-7-13;1-12-14(19)8-9-15(20)17(12)21-16(10-11-18-2)13-6-4-3-5-7-13;1-12-8-9-14(19)16(20)17(12)21-15(10-11-18-2)13-6-4-3-5-7-13/h3*3-7,10-11,16,18-20H,8-9H2,1-2H3;2*3-9,16,18-20H,10-11H2,1-2H3;3-9,15,18-20H,10-11H2,1-2H3 |
| InChIKey | QRPFXPSFGLUJJE-UHFFFAOYSA-N |
| Mol Weight | 287.36 g/mol |
| Molecular Formula | C17H21NO3 |
| Exact Mass | 287.152144 g/mol |
Mass Spectrum (LC)
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| SpectraBase Spectrum ID | CJBlc3HMlLA |
|---|---|
| Name | Atomoxetine-M (di-HO-) MS2 |
| Comments | F: ITMS + c ESI d w Full ms2 [email protected] [65.00-300.00] |
| Copyright | Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C17H21NO3 |
| Ion Polarity | P |
| Ionization Type | ESI |
| Sample Comments | The MWW Reference Handbook and associated table are attached to Record #1, under the Attachments tab. Refer to these references for the sample preparation procedure and abbreviations, as well as other relevant information pertaining to this database. |
| Sample Description | Analyte Type: Metabolite |
| Source of Spectrum | Maurer/Wissenbach/Weber, Saarland University |
| Spectrum Type | ms2 |
| Technique | ITMS |