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Nifedipine ME
SpectraBase Compound ID 97Ok8GFLZ2m
InChI InChI=1S/C18H20N2O6/c1-10-14(17(21)25-4)16(12-8-6-7-9-13(12)20(23)24)15(18(22)26-5)11(2)19(10)3/h6-9,16H,1-5H3
InChIKey CYCWGQFQPAYBHG-UHFFFAOYSA-N
Mol Weight 360.37 g/mol
Molecular Formula C18H20N2O6
Exact Mass 360.132136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID t4smk5zv6
Name Nifedipine ME
Classification Ca Antagonist
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Exact Mass 360.132136366 u
Formula C18H20N2O6
InChI InChI=1S/C18H20N2O6/c1-10-14(17(21)25-4)16(12-8-6-7-9-13(12)20(23)24)15(18(22)26-5)11(2)19(10)3/h6-9,16H,1-5H3
InChIKey CYCWGQFQPAYBHG-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 360.366 g/mol
SMILES c1cccc(c1C1C(=C(N(C(=C1C(OC)=O)C)C)C)C(OC)=O)N(=O)=O
SPLASH splash10-0007-1095000000-d35d2962b58df5181a3e
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.
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_4876