| SpectraBase Compound ID | 4ss2dL4dfMT |
|---|---|
| InChI | InChI=1S/5C15H22N2O2/c1-3-17(4-2)14(19)15(9-12(15)10-16)11-5-7-13(18)8-6-11;2*1-3-17(4-2)14(19)15(9-12(15)10-16)11-6-5-7-13(18)8-11;2*1-3-17(4-2)14(19)15(9-11(15)10-16)12-7-5-6-8-13(12)18/h3*5-8,12,18H,3-4,9-10,16H2,1-2H3;2*5-8,11,18H,3-4,9-10,16H2,1-2H3 |
| InChIKey | YDJAYIHTLFFQLS-UHFFFAOYSA-N |
| Mol Weight | 262.35 g/mol |
| Molecular Formula | C15H22N2O2 |
| Exact Mass | 262.168128 g/mol |
Mass Spectrum (LC)
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| SpectraBase Spectrum ID | AU8RLoiWm0 |
|---|---|
| Name | Milnaciprane-M (HO-ring) MS2 |
| Comments | F: ITMS + c ESI d w Full ms2 263.10 |
| Copyright | Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C15H22N2O2 |
| 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 |