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Nifedipine-M AC
SpectraBase Compound ID FX6eE8bWyX0
InChI InChI=1S/C18H16N2O8/c1-9-14(18(24)27-3)15(11-6-4-5-7-13(11)20(25)26)16(17(22)23)12(19-9)8-28-10(2)21/h4-7H,8H2,1-3H3,(H,22,23)
InChIKey XHMHYWBMGIHIHC-UHFFFAOYSA-N
Mol Weight 388.33 g/mol
Molecular Formula C18H16N2O8
Exact Mass 388.090665 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CdJAmLvctx9
Name Nifedipine-M AC
Classification Ca Antagonist
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Exact Mass 388.090665475 u
Formula C18H16N2O8
InChI InChI=1S/C18H16N2O8/c1-9-14(18(24)27-3)15(11-6-4-5-7-13(11)20(25)26)16(17(22)23)12(19-9)8-28-10(2)21/h4-7H,8H2,1-3H3,(H,22,23)
InChIKey XHMHYWBMGIHIHC-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 388.332 g/mol
SMILES c1cccc(c1-c1c(c(nc(c1C(O)=O)COC(C)=O)C)C(=O)OC)N(=O)=O
SPLASH splash10-003i-0449000000-a090fce210edd05318c3
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: UHYAC
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms Nifedipine-M (dehydro-HO-HOOC-) AC
Technique GC/MS
Wiley ID MMPW6e_2493