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Nicardipine-M (deamino-HOOC-) ME
SpectraBase Compound ID DQETqWRQEYY
InChI InChI=1S/C19H20N2O8/c1-10-15(18(23)28-4)17(12-6-5-7-13(8-12)21(25)26)16(11(2)20-10)19(24)29-9-14(22)27-3/h5-8,17,20H,9H2,1-4H3
InChIKey XIXUCBSISABPEU-UHFFFAOYSA-N
Mol Weight 404.38 g/mol
Molecular Formula C19H20N2O8
Exact Mass 404.121966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AF50dPTXIpr
Name Nicardipine-M (deamino-HOOC-) ME
Classification Ca Antagonist
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Exact Mass 404.121965604 u
Formula C19H20N2O8
InChI InChI=1S/C19H20N2O8/c1-10-15(18(23)28-4)17(12-6-5-7-13(8-12)21(25)26)16(11(2)20-10)19(24)29-9-14(22)27-3/h5-8,17,20H,9H2,1-4H3
InChIKey XIXUCBSISABPEU-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 404.375 g/mol
SMILES C=1(C(C(C(=O)OC)=C(NC1C)C)c1cc(N(=O)=O)ccc1)C(OCC(=O)OC)=O
SPLASH splash10-001i-1391000000-62470af25e498c8314b6
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: UME
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_4879