| SpectraBase Compound ID | J6U8aF9jRxK |
|---|---|
| InChI | InChI=1S/6C19H21NO2/c1-20-12-4-7-16-15-6-3-2-5-13(15)8-9-14-10-11-17(21)19(22)18(14)16;1-20-12-4-7-15-14-6-3-2-5-13(14)8-9-17-16(15)10-11-18(21)19(17)22;1-20-12-4-7-15-14-6-3-2-5-13(14)8-9-16-17(21)10-11-18(22)19(15)16;1-20-10-4-7-16-15-6-3-2-5-13(15)8-9-17-18(16)11-14(21)12-19(17)22;1-20-10-4-7-17-16-6-3-2-5-13(16)8-9-14-11-15(21)12-18(22)19(14)17;1-20-10-4-7-16-15-6-3-2-5-13(15)8-9-14-11-18(21)19(22)12-17(14)16/h2-3,5-6,8-11,16,20-22H,4,7,12H2,1H3;2*2-3,5-6,8-11,15,20-22H,4,7,12H2,1H3;2-3,5-6,8-9,11-12,16,20-22H,4,7,10H2,1H3;2-3,5-6,8-9,11-12,17,20-22H,4,7,10H2,1H3;2-3,5-6,8-9,11-12,16,20-22H,4,7,10H2,1H3 |
| InChIKey | JHFDRHQOYWUCRS-UHFFFAOYSA-N |
| Mol Weight | 295.38 g/mol |
| Molecular Formula | C19H21NO2 |
| Exact Mass | 295.157229 g/mol |
Mass Spectrum (LC)
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| SpectraBase Spectrum ID | DSc6c2AHeYp |
|---|---|
| Name | Protriptyline-M (di-HO-ring) MS2 |
| Comments | F: ITMS + c ESI d w Full ms2 296.10 |
| Copyright | Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C19H21NO2 |
| 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 |