| SpectraBase Spectrum ID |
JYQEPVp8bQG |
| Name |
2C-E-M (HO-) isomer 2 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/c1-4-8-5-12(16-3)9(10(14)7-13)6-11(8)15-2/h5-6,10,14H,4,7,13H2,1-3H3 |
| InChIKey |
QFOGKMIVOSUPQZ-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
NCC(C=1C(OC)=CC(CC)=C(OC)C1)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 |
