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Isradipine artifact (298) MS2
SpectraBase Compound ID CelxC9KybYA
InChI InChI=1S/C15H11N3O4/c1-7-10(6-19)13(12(15(20)21)8(2)16-7)9-4-3-5-11-14(9)18-22-17-11/h3-5,13,16H,1-2H3/p+1
InChIKey UYJZHDKZVJYPNH-UHFFFAOYSA-O
Mol Weight 298.28 g/mol
Molecular Formula C15H12N3O4
Exact Mass 298.082781 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 9eiXTsLkC8
Name Isradipine artifact (298) MS2
Comments F: ITMS + c ESI d w Full ms2 298.10
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InChI InChI=1S/C15H11N3O4/c1-7-10(6-19)13(12(15(20)21)8(2)16-7)9-4-3-5-11-14(9)18-22-17-11/h3-5,13,16H,1-2H3/p+1
InChIKey UYJZHDKZVJYPNH-UHFFFAOYSA-O
Ion Polarity P
Ionization Type ESI
SMILES OC(C1=C(N[C+](C(C1C=1C=2C(=NON2)C=CC1)=C=O)C)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: Parent
Source of Spectrum Maurer/Wissenbach/Weber, Saarland University
Spectrum Type ms2
Technique ITMS