| SpectraBase Compound ID | AJEdH9JFPdn |
|---|---|
| InChI | InChI=1S/3C25H29NO3/c1-29-25-13-7-3-9-19(25)16-24(28)21-17-26(22-11-5-4-10-20(21)22)15-14-18-8-2-6-12-23(18)27;1-29-25-12-5-2-8-19(25)16-24(28)22-17-26(23-11-4-3-10-21(22)23)14-13-18-7-6-9-20(27)15-18;1-29-25-9-5-2-6-19(25)16-24(28)22-17-26(23-8-4-3-7-21(22)23)15-14-18-10-12-20(27)13-11-18/h3-5,7,9-11,13,17-18,23,27H,2,6,8,12,14-16H2,1H3;2-5,8,10-12,17-18,20,27H,6-7,9,13-16H2,1H3;2-9,17-18,20,27H,10-16H2,1H3 |
| InChIKey | LHTCMUSJNVIIHY-UHFFFAOYSA-N |
| Mol Weight | 391.51 g/mol |
| Molecular Formula | C25H29NO3 |
| Exact Mass | 391.214744 g/mol |
Mass Spectrum (LC)
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| SpectraBase Spectrum ID | 9AKSSSoJjU |
|---|---|
| Name | RCS-08-M (HO-) isomer 1 MS2 |
| Comments | F: ITMS + c ESI d w Full ms2 392.30 |
| Copyright | Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C25H29NO3 |
| 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 |