| SpectraBase Compound ID | 9HrNWztLLAS |
|---|---|
| InChI | InChI=1S/C19H26FN3O2.CH4O/c1-13(2)17(18(21)24)22-19(25)15-12-23(11-7-3-6-10-20)16-9-5-4-8-14(15)16;1-2/h4-5,8-9,12-13,17H,3,6-7,10-11H2,1-2H3,(H2,21,24)(H,22,25);2H,1H3 |
| InChIKey | DPGUGUQIBMCRGD-UHFFFAOYSA-N |
| Mol Weight | 379.48 g/mol |
| Molecular Formula | C20H30FN3O3 |
| Exact Mass | 379.22712 g/mol |
Mass Spectrum (LC)
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| SpectraBase Spectrum ID | C0O1RFLbhK3 |
|---|---|
| Name | 5-F-AB-PICA-M (HO-) isomer 2 MS2 |
| Comments | F: ITMS + c ESI d w Full ms2 364.30 |
| Copyright | Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C19H26FN3O3 |
| 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 |