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Valsartan MS2
SpectraBase Compound ID LZuNExHnkg0
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
Mol Weight 435.53 g/mol
Molecular Formula C24H29N5O3
Exact Mass 435.22704 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 5pPZlVXYg4
Name Valsartan artifact (481) MS3_1
Comments T: ITMS + c ESI d w Full ms3 [email protected] [email protected]
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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