SpectraBase Spectrum ID |
GUBGFqw7pjY |
Name |
Ferulic acid glycine conjugate MS2 |
Comments |
F: ITMS + c ESI d w Full ms2 252.10 |
Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
Formula |
C12H13NO5 |
InChI |
InChI=1S/C12H13NO5/c1-18-10-6-8(2-4-9(10)14)3-5-11(15)13-7-12(16)17/h2-6,14H,7H2,1H3,(H,13,15)(H,16,17)/b5-3+ |
InChIKey |
CLGNQAIRBLDHIN-HWKANZROSA-N |
Ion Polarity |
P |
Ionization Type |
ESI |
SMILES |
OC(CNC(\C=C\C1=CC=C(C(=C1)OC)O)=O)=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: Parent |
Source of Spectrum |
Maurer/Wissenbach/Weber, Saarland University |
Spectrum Type |
ms2 |
Technique |
ITMS |