| SpectraBase Compound ID | EMhvzQKB3ac |
|---|---|
| InChI | InChI=1S/4C23H23N3O2.4CH4O/c1-2-3-6-15-26-19-13-5-4-11-17(19)22(25-26)23(28)24-18-12-7-9-16-10-8-14-20(27)21(16)18;1-2-3-6-15-26-20-13-5-4-9-18(20)22(25-26)23(28)24-19-12-7-11-17-16(19)10-8-14-21(17)27;1-2-3-6-14-26-21-11-5-4-9-19(21)22(25-26)23(28)24-20-10-7-8-16-15-17(27)12-13-18(16)20;1-2-3-6-14-26-21-11-5-4-9-18(21)22(25-26)23(28)24-20-10-7-8-16-12-13-17(27)15-19(16)20;4*1-2/h2*4-5,7-14,27H,2-3,6,15H2,1H3,(H,24,28);2*4-5,7-13,15,27H,2-3,6,14H2,1H3,(H,24,28);4*2H,1H3 |
| InChIKey | OGRUTBOGIIQJEG-UHFFFAOYSA-N |
| Mol Weight | 405.5 g/mol |
| Molecular Formula | C24H27N3O3 |
| Exact Mass | 405.205242 g/mol |
Mass Spectrum (LC)
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| SpectraBase Spectrum ID | 9Unw85isc4 |
|---|---|
| Name | MN-18-M (di-HO-) MS2 |
| Comments | F: ITMS + c ESI d w Full ms2 390.30 |
| Copyright | Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C23H23N3O3 |
| 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 |