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Nifedipine-M (dehydro-HOOC-) TMS
SpectraBase Compound ID IatMfKulq1c
InChI InChI=1S/C20H22N2O8Si/c1-11-14(18(23)28-2)15(12-9-7-8-10-13(12)22(26)27)16(19(24)29-3)17(21-11)20(25)30-31(4,5)6/h7-10H,1-6H3
InChIKey WTJGNIDAUZPORU-UHFFFAOYSA-N
Mol Weight 446.49 g/mol
Molecular Formula C20H22N2O8Si
Exact Mass 446.114542 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H2whW2Ss3Qe
Name Nifedipine-M (dehydro-HOOC-) TMS
Classification Ca Antagonist
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Exact Mass 446.114542203 u
Formula C20H22N2O8Si
InChI InChI=1S/C20H22N2O8Si/c1-11-14(18(23)28-2)15(12-9-7-8-10-13(12)22(26)27)16(19(24)29-3)17(21-11)20(25)30-31(4,5)6/h7-10H,1-6H3
InChIKey WTJGNIDAUZPORU-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 446.487 g/mol
SMILES c1cccc(N(=O)=O)c1-c1c(c(nc(c1C(=O)OC)C(=O)O[Si](C)(C)C)C)C(=O)OC
SPLASH splash10-0f89-1245900000-9ee38e0392a0e0cb352c
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: UTMS
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_5012