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Diltiazem-M (desacetyl)
SpectraBase Compound ID B20PMojIwH7
InChI InChI=1S/C20H24N2O3S/c1-21(2)12-13-22-16-6-4-5-7-17(16)26-19(18(23)20(22)24)14-8-10-15(25-3)11-9-14/h4-11,18-19,23H,12-13H2,1-3H3
InChIKey NZHUXMZTSSZXSB-UHFFFAOYSA-N
Mol Weight 372.48 g/mol
Molecular Formula C20H24N2O3S
Exact Mass 372.150764 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4ZN5wnW5Y3N
Name Diltiazem-M (deacetyl-)
Classification Ca Antagonist
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Exact Mass 372.150763812 u
Formula C20H24N2O3S
InChI InChI=1S/C20H24N2O3S/c1-21(2)12-13-22-16-6-4-5-7-17(16)26-19(18(23)20(22)24)14-8-10-15(25-3)11-9-14/h4-11,18-19,23H,12-13H2,1-3H3
InChIKey NZHUXMZTSSZXSB-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 372.483 g/mol
SMILES c12N(C(=O)C(O)C(c3ccc(OC)cc3)Sc2cccc1)CCN(C)C
SPLASH splash10-0a4i-9100000000-ac1137be7634169bef48
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Sample Preparation Procedure Detected: P UHY
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_2505