| SpectraBase Compound ID | tpkCDqsGvr |
|---|---|
| InChI | InChI=1S/C24H31FN2O.CH4O2/c25-8-4-1-5-9-27-16-21(20-6-2-3-7-22(20)27)23(28)26-24-13-17-10-18(14-24)12-19(11-17)15-24;2-1-3/h2-3,6-7,16-19H,1,4-5,8-15H2,(H,26,28);2-3H,1H2 |
| InChIKey | LGQPCFXJDFCOTD-UHFFFAOYSA-N |
| Mol Weight | 430.56 g/mol |
| Molecular Formula | C25H35FN2O3 |
| Exact Mass | 430.263171 g/mol |
Mass Spectrum (LC)
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| SpectraBase Spectrum ID | E3x1WHVoKv3 |
|---|---|
| Name | STS-135-M (di-HO-) isomer 2 MS2 |
| Comments | F: ITMS + c ESI d w Full ms2 415.30 |
| Copyright | Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C24H31FN2O3 |
| 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 |