| SpectraBase Compound ID | LCWUl4c5zHg |
|---|---|
| InChI | InChI=1S/3C18H23N3O2/c1-2-11-19-18(23)17-14-8-4-5-9-15(14)21(20-17)12-13-7-3-6-10-16(13)22;1-2-10-19-18(23)17-15-8-3-4-9-16(15)21(20-17)12-13-6-5-7-14(22)11-13;1-2-11-19-18(23)17-15-5-3-4-6-16(15)21(20-17)12-13-7-9-14(22)10-8-13/h2,4-5,8-9,11,13,16,22H,3,6-7,10,12H2,1H3,(H,19,23);2-4,8-10,13-14,22H,5-7,11-12H2,1H3,(H,19,23);2-6,11,13-14,22H,7-10,12H2,1H3,(H,19,23)/p+3/b11-2-;10-2-;11-2- |
| InChIKey | IIYGZNYXGCAHSF-HAPKBCIBSA-Q |
| Mol Weight | 314.41 g/mol |
| Molecular Formula | C18H24N3O2 |
| Exact Mass | 314.186852 g/mol |
Mass Spectrum (LC)
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| SpectraBase Spectrum ID | 7Kf4XmcmbQ |
|---|---|
| Name | AB-CHMINACA-M (di-HO-) MS3_2 |
| Comments | F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [75.00-325.00] |
| Copyright | Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| 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 | ms3 |
| Technique | ITMS |