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Diltiazem-M (HO-ring) MS2
SpectraBase Compound ID HsSTOVVkwyF
InChI InChI=1S/4C22H26N2O5S/c1-14(25)29-20-21(15-5-8-17(28-4)9-6-15)30-19-10-7-16(26)13-18(19)24(22(20)27)12-11-23(2)3;1-14(25)29-20-21(15-5-8-17(28-4)9-6-15)30-19-13-16(26)7-10-18(19)24(22(20)27)12-11-23(2)3;1-14(25)29-19-20(15-8-10-16(28-4)11-9-15)30-21-17(6-5-7-18(21)26)24(22(19)27)13-12-23(2)3;1-14(25)29-20-21(15-8-10-16(28-4)11-9-15)30-18-7-5-6-17(26)19(18)24(22(20)27)13-12-23(2)3/h2*5-10,13,20-21,26H,11-12H2,1-4H3;5-11,19-20,26H,12-13H2,1-4H3;5-11,20-21,26H,12-13H2,1-4H3
InChIKey WHWIRCBAQDXXRH-UHFFFAOYSA-N
Mol Weight 430.52 g/mol
Molecular Formula C22H26N2O5S
Exact Mass 430.156243 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 9fQl3CZFxlh
Name Diltiazem-M (HO-ring) MS2
Comments F: ITMS + c ESI d w Full ms2 431.30
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Ion Polarity P
Ionization Type ESI
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