| SpectraBase Spectrum ID |
8U8EClqY0e |
| Name |
2C-E-M (HO-) isomer 1 MS2 |
| Comments |
F: ITMS + c ESI d w Full ms2 226.10 |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C12H19NO3 |
| InChI |
InChI=1S/C12H19NO3/c1-15-11-8-10(4-6-14)12(16-2)7-9(11)3-5-13/h7-8,14H,3-6,13H2,1-2H3 |
| InChIKey |
TVZYKZDNRZPTDL-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
OCCC=1C=C(C(CCN)=CC1OC)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 |
