| SpectraBase Compound ID | 5loUmuD5cOP |
|---|---|
| InChI | InChI=1S/4C25H27ClN2O/c1-19-6-5-9-22(25(19)29)18-27-14-16-28(17-15-27)24(20-7-3-2-4-8-20)21-10-12-23(26)13-11-21;1-19-17-20(7-12-24(19)29)18-27-13-15-28(16-14-27)25(21-5-3-2-4-6-21)22-8-10-23(26)11-9-22;1-19-7-12-24(29)22(17-19)18-27-13-15-28(16-14-27)25(20-5-3-2-4-6-20)21-8-10-23(26)11-9-21;1-19-15-20(17-24(29)16-19)18-27-11-13-28(14-12-27)25(21-5-3-2-4-6-21)22-7-9-23(26)10-8-22/h2-13,24,29H,14-18H2,1H3;2*2-12,17,25,29H,13-16,18H2,1H3;2-10,15-17,25,29H,11-14,18H2,1H3 |
| InChIKey | MGFQZPHTAMUXSR-UHFFFAOYSA-N |
| Mol Weight | 406.96 g/mol |
| Molecular Formula | C25H27ClN2O |
| Exact Mass | 406.181191 g/mol |
Mass Spectrum (LC)
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| SpectraBase Spectrum ID | BmgsiedJdcQ |
|---|---|
| Name | Meclozine-M (HO-aryl) MS2 |
| Comments | F: ITMS + c ESI d w Full ms2 407.10 |
| Copyright | Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| 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 |