| SpectraBase Compound ID | 6Bae1UTp0F3 |
|---|---|
| InChI | InChI=1S/3C26H36N2O5/c1-18(2)26(17-27,20-9-11-21(31-4)23(16-20)33-6)13-7-14-28(3)15-12-19-8-10-22(32-5)25(30)24(19)29;1-18(2)26(17-27,20-8-9-23(31-4)25(15-20)33-6)11-7-12-28(3)13-10-19-14-22(30)24(32-5)16-21(19)29;1-18(2)26(17-27,20-8-9-23(31-4)24(16-20)32-5)11-7-12-28(3)13-10-19-14-21(29)25(33-6)22(30)15-19/h8-11,16,18,29-30H,7,12-15H2,1-6H3;2*8-9,14-16,18,29-30H,7,10-13H2,1-6H3 |
| InChIKey | LLFZCDBNJDLMAE-UHFFFAOYSA-N |
| Mol Weight | 456.6 g/mol |
| Molecular Formula | C26H36N2O5 |
| Exact Mass | 456.262422 g/mol |
Mass Spectrum (LC)
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| SpectraBase Spectrum ID | FTUktfJmxG6 |
|---|---|
| Name | Verapamil-M (O-demethyl-HO-) isomer 1 MS2 |
| Comments | T: ITMS + c ESI d w Full ms2 [email protected] [115.00-470.00] |
| Copyright | Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C26H36N2O5 |
| 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 |