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Diltiazem-M (O-demethyl-) HY
SpectraBase Compound ID 8irqrshODyY
InChI InChI=1S/C19H22N2O3S/c1-20(2)11-12-21-15-5-3-4-6-16(15)25-18(17(23)19(21)24)13-7-9-14(22)10-8-13/h3-10,17-18,22-23H,11-12H2,1-2H3
InChIKey QYKYTLTVPBXRNC-UHFFFAOYSA-N
Mol Weight 358.46 g/mol
Molecular Formula C19H22N2O3S
Exact Mass 358.135114 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5UnCo08bVQf
Name Diltiazem-M (O-demethyl-) HY
Classification Ca Antagonist
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Exact Mass 358.135113747 u
Formula C19H22N2O3S
InChI InChI=1S/C19H22N2O3S/c1-20(2)11-12-21-15-5-3-4-6-16(15)25-18(17(23)19(21)24)13-7-9-14(22)10-8-13/h3-10,17-18,22-23H,11-12H2,1-2H3
InChIKey QYKYTLTVPBXRNC-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 358.456 g/mol
SMILES c1(ccc(cc1)O)C1C(O)C(N(c2c(cccc2)S1)CCN(C)C)=O
SPLASH splash10-0a4i-9200000000-c6c3659ebd4ed99acae1
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_2707