| SpectraBase Spectrum ID |
4B93NbpLzMO |
| Name |
Butylscopolamine-M (330) MS2 |
| Comments |
F: ITMS + c ESI d w Full ms2 330.10 |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C20H28NO3 |
| InChI |
InChI=1S/C20H28NO3/c1-3-4-10-21(2)16-12-15(13-17(21)20-19(16)24-20)23-18(22)11-14-8-6-5-7-9-14/h5-9,15-17,19-20H,3-4,10-13H2,1-2H3/q+1/t15?,16-,17+,19?,20?,21- |
| InChIKey |
XKNXMKJAQJNBMX-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
C1=CC=CC=C1CC(OC1C[C@@]2([N@+]([C@@](C3C2O3)(C1)[H])(C)CCCC)[H])=O |
| 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 |
