| SpectraBase Spectrum ID |
9UXEZtDaiW |
| Name |
4-EA-NBOMe-M (carboxy-) MS2 |
| Comments |
T: ITMS + c ESI d w Full ms2 [email protected] [75.00-325.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C19H23NO3 |
| InChI |
InChI=1S/C19H23NO3/c1-14(20-13-17-5-3-4-6-18(17)23-2)11-15-7-9-16(10-8-15)12-19(21)22/h3-10,14,20H,11-13H2,1-2H3,(H,21,22) |
| InChIKey |
LGBGMZFHRFERHG-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
OC(CC=1C=CC(CC(NCC=2C(=CC=CC2)OC)C)=CC1)=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 |
