| SpectraBase Spectrum ID |
9ejyMZe2R2R |
| Name |
U-47700-M (N,N-bis-demethyl-HO-) MS3_2 |
| Comments |
F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [50.00-185.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| InChI |
InChI=1S/C7H3Cl2O/c8-6-2-1-5(4-10)3-7(6)9/h1-3H/q+1 |
| InChIKey |
OZTCRCJUXJYSPM-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
C=1(C=CC(=C(C1)Cl)Cl)[C+]=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 |
ms3 |
| Technique |
ITMS |
