SpectraBase Spectrum ID |
5pPZlVXYg4 |
Name |
Valsartan artifact (481) MS3_1 |
Comments |
T: ITMS + c ESI d w Full ms3 [email protected] [email protected] |
Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
Formula |
C24H29N5O3 |
InChI |
InChI=1S/C24H29N5O3/c1-4-5-10-21(30)29(22(16(2)3)24(31)32)15-17-11-13-18(14-12-17)19-8-6-7-9-20(19)23-25-27-28-26-23/h6-9,11-14,16,22H,4-5,10,15H2,1-3H3,(H,31,32)(H,25,26,27,28) |
InChIKey |
ACWBQPMHZXGDFX-UHFFFAOYSA-N |
Ion Polarity |
P |
Ionization Type |
ESI |
SMILES |
N1N=NN=C1C1=C(C2=CC=C(CN(C(C(=O)O)C(C)C)C(=O)CCCC)C=C2)C=CC=C1 |
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 |
ms3 |
Technique |
ITMS |