| SpectraBase Compound ID | CfLlfItOqxG |
|---|---|
| InChI | InChI=1S/4C25H24FNO3/c26-13-4-1-5-14-27-15-21(19-7-2-3-9-22(19)27)25(30)20-12-11-17(16-28)18-8-6-10-23(29)24(18)20;26-13-4-1-5-14-27-15-21(18-7-2-3-9-22(18)27)25(30)20-12-11-17(16-28)24-19(20)8-6-10-23(24)29;26-12-4-1-5-13-27-15-23(20-6-2-3-7-24(20)27)25(30)21-10-8-17(16-28)22-14-18(29)9-11-19(21)22;26-12-4-1-5-13-27-15-23(20-6-2-3-7-24(20)27)25(30)21-10-8-17(16-28)19-11-9-18(29)14-22(19)21/h2*2-3,6-12,15,28-29H,1,4-5,13-14,16H2;2*2-3,6-11,14-15,28-29H,1,4-5,12-13,16H2 |
| InChIKey | JLKBRZDKXILSPV-UHFFFAOYSA-N |
| Mol Weight | 405.47 g/mol |
| Molecular Formula | C25H24FNO3 |
| Exact Mass | 405.174022 g/mol |
Mass Spectrum (LC)
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| SpectraBase Spectrum ID | 7pZJOJIJzE |
|---|---|
| Name | MAM-2201-M (di-HO-) isomer 2 MS2 |
| Comments | F: ITMS + c ESI d w Full ms2 406.30 |
| Copyright | Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C25H24FNO3 |
| 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 |