| SpectraBase Compound ID | BqoZht7xocl |
|---|---|
| InChI | InChI=1S/4C19H22ClN5O2/c20-15-5-3-6-16(18(15)26)23-13-11-22(12-14-23)8-4-10-25-19(27)24-9-2-1-7-17(24)21-25;20-16-14-15(5-6-17(16)26)23-12-10-22(11-13-23)7-3-9-25-19(27)24-8-2-1-4-18(24)21-25;20-15-5-6-17(26)16(14-15)23-12-10-22(11-13-23)7-3-9-25-19(27)24-8-2-1-4-18(24)21-25;20-15-12-16(14-17(26)13-15)23-10-8-22(9-11-23)5-3-7-25-19(27)24-6-2-1-4-18(24)21-25/h1-3,5-7,9,26H,4,8,10-14H2;2*1-2,4-6,8,14,26H,3,7,9-13H2;1-2,4,6,12-14,26H,3,5,7-11H2 |
| InChIKey | QEOPJYYKTDMDAC-UHFFFAOYSA-N |
| Mol Weight | 387.87 g/mol |
| Molecular Formula | C19H22ClN5O2 |
| Exact Mass | 387.146203 g/mol |
Mass Spectrum (LC)
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| SpectraBase Spectrum ID | MouNi09Qla |
|---|---|
| Name | Trazodone-M (HO-aryl-sulfate) MS3_1 |
| Comments | F: ITMS + c ESI d w Full ms3 [email protected] [email protected] |
| Copyright | Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C19H22ClN5O2 |
| 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 | ms3 |
| Technique | ITMS |