| SpectraBase Spectrum ID |
LJ3ikOrTIKp |
| Name |
A-796.260-M (N,N-bisdealkyl-deamino-HO-) MS3_1 |
| Comments |
F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [50.00-200.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C11H10NO2 |
| InChI |
InChI=1S/C11H10NO2/c13-6-5-12-7-9(8-14)10-3-1-2-4-11(10)12/h1-4,7,13H,5-6H2/q+1 |
| InChIKey |
XHRCDVCKBFWECE-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
OCCN1C=2C=CC=CC2C(=C1)[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 |
