| SpectraBase Compound ID | HYU7PZWzkBU |
|---|---|
| InChI | InChI=1S/4C24H24N2O2.4CH4O/c1-2-3-6-15-26-16-20(19-12-8-14-22(27)23(19)26)24(28)25-21-13-7-10-17-9-4-5-11-18(17)21;1-2-3-6-15-26-16-19(23-21(26)13-8-14-22(23)27)24(28)25-20-12-7-10-17-9-4-5-11-18(17)20;1-2-3-6-14-26-16-21(20-15-18(27)12-13-23(20)26)24(28)25-22-11-7-9-17-8-4-5-10-19(17)22;1-2-3-6-14-26-16-21(20-13-12-18(27)15-23(20)26)24(28)25-22-11-7-9-17-8-4-5-10-19(17)22;4*1-2/h2*4-5,7-14,16,27H,2-3,6,15H2,1H3,(H,25,28);2*4-5,7-13,15-16,27H,2-3,6,14H2,1H3,(H,25,28);4*2H,1H3 |
| InChIKey | BMQQZCLOJVUIGQ-UHFFFAOYSA-N |
| Mol Weight | 404.51 g/mol |
| Molecular Formula | C25H28N2O3 |
| Exact Mass | 404.209993 g/mol |
Mass Spectrum (LC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | AU8uSkpsgq |
|---|---|
| Name | NNEI-M (di-HO-) isomer 1 MS2 |
| Comments | F: ITMS + c ESI d w Full ms2 389.30 |
| Copyright | Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C24H24N2O3 |
| 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 |