| SpectraBase Spectrum ID |
6Us4DXtJjM |
| Name |
2C-D-M (HO-ring) MS2 |
| Comments |
F: ITMS + c ESI d w Full ms2 212.10 |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C11H17NO3 |
| InChI |
InChI=1S/C11H17NO3/c1-7-6-9(14-2)8(4-5-12)10(13)11(7)15-3/h6,13H,4-5,12H2,1-3H3 |
| InChIKey |
KEPWYCQIKUCDDQ-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
NCCC=1C(=CC(=C(C1O)OC)C)OC |
| 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 |
