| SpectraBase Spectrum ID |
BOy5ZlAvVpM |
| Name |
MDAI-M (demethylenyl-) MS2 |
| Comments |
T: ITMS + c ESI d w Full ms2 [email protected] [50.00-180.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C9H11NO2 |
| InChI |
InChI=1S/C9H11NO2/c10-7-1-5-3-8(11)9(12)4-6(5)2-7/h3-4,7,11-12H,1-2,10H2 |
| InChIKey |
MTDARFGDCNHWEK-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
OC=1C=C2C(CC(C2)N)=CC1O |
| 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 |
