| SpectraBase Spectrum ID |
GQmjD92fCTz |
| Name |
N-Methyl-DOB-M (O-demethyl-) MS2 |
| Comments |
T: ITMS + c ESI d w Full ms2 [email protected] [60.00-285.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C11H16BrNO2 |
| InChI |
InChI=1S/C11H16BrNO2/c1-7(13-2)4-8-5-11(15-3)9(12)6-10(8)14/h5-7,13-14H,4H2,1-3H3 |
| InChIKey |
QACNWRPONLFUDX-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
OC=1C(CC(C)NC)=CC(=C(C1)Br)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 |
