| SpectraBase Compound ID | 1y9mM7TOjfC |
|---|---|
| InChI | InChI=1S/3C20H28N4O4/c1-12(11-25)17(19(21)27)22-20(28)18-14-7-3-4-8-15(14)24(23-18)10-13-6-2-5-9-16(13)26;1-12(11-25)17(19(21)27)22-20(28)18-15-7-2-3-8-16(15)24(23-18)10-13-5-4-6-14(26)9-13;1-12(11-25)17(19(21)27)22-20(28)18-15-4-2-3-5-16(15)24(23-18)10-13-6-8-14(26)9-7-13/h3-4,7-8,12-13,16-17,25-26H,2,5-6,9-11H2,1H3,(H2,21,27)(H,22,28);2-3,7-8,12-14,17,25-26H,4-6,9-11H2,1H3,(H2,21,27)(H,22,28);2-5,12-14,17,25-26H,6-11H2,1H3,(H2,21,27)(H,22,28) |
| InChIKey | ZPDVOIMIFZFZMS-UHFFFAOYSA-N |
| Mol Weight | 388.47 g/mol |
| Molecular Formula | C20H28N4O4 |
| Exact Mass | 388.211055 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 | 5UM2E03Ozo |
|---|---|
| Name | AB-CHMINACA-M (di-HO-) MS2 |
| Comments | F: ITMS + c ESI d w Full ms2 389.10 |
| Copyright | Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C20H28N4O4 |
| 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 |