| SpectraBase Compound ID | 8JksTiZOtmU |
|---|---|
| InChI | InChI=1S/C24H24N2O.CH4O2/c1-2-3-8-16-26-17-21(20-13-6-7-15-23(20)26)24(27)25-22-14-9-11-18-10-4-5-12-19(18)22;2-1-3/h4-7,9-15,17H,2-3,8,16H2,1H3,(H,25,27);2-3H,1H2 |
| InChIKey | TYPNMMLYVRBMNX-UHFFFAOYSA-N |
| Mol Weight | 404.51 g/mol |
| Molecular Formula | C25H28N2O3 |
| Exact Mass | 404.209993 g/mol |
Mass Spectrum (LC)
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| SpectraBase Spectrum ID | 9AAw85G1Zo |
|---|---|
| Name | NNEI-M (di-HO-) isomer 3 MS2 |
| Comments | F: ITMS + c ESI d w Full ms2 389.30 |
| Copyright | Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C24H24N2O3 |
| 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 |