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Diltiazem-M (deamino-HO-) HY
SpectraBase Compound ID 1kBOOilvGjA
InChI InChI=1S/C18H19NO4S/c1-23-13-8-6-12(7-9-13)17-16(21)18(22)19(10-11-20)14-4-2-3-5-15(14)24-17/h2-9,16-17,20-21H,10-11H2,1H3
InChIKey KGGGMORTSFTLQR-UHFFFAOYSA-N
Mol Weight 345.41 g/mol
Molecular Formula C18H19NO4S
Exact Mass 345.103479 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 995YQDVM3r0
Name Diltiazem-M (deamino-HO-) HY
Classification Ca Antagonist
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Exact Mass 345.103479266 u
Formula C18H19NO4S
InChI InChI=1S/C18H19NO4S/c1-23-13-8-6-12(7-9-13)17-16(21)18(22)19(10-11-20)14-4-2-3-5-15(14)24-17/h2-9,16-17,20-21H,10-11H2,1H3
InChIKey KGGGMORTSFTLQR-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 345.413 g/mol
SMILES c1(ccc(cc1)OC)C1C(O)C(N(c2c(cccc2)S1)CCO)=O
SPLASH splash10-00xr-0925000000-de23fdfd23ff26224103
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: 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_2706