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Lercanidipine-A 1
SpectraBase Compound ID IVxTxxBHkOq
InChI InChI=1S/C16H16N2O6/c1-8-12(15(19)20)14(13(9(2)17-8)16(21)24-3)10-5-4-6-11(7-10)18(22)23/h4-7,14,17H,1-3H3,(H,19,20)
InChIKey JPXPPUOCSLMCHK-UHFFFAOYSA-N
Mol Weight 332.31 g/mol
Molecular Formula C16H16N2O6
Exact Mass 332.100836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JGTVMlJamP2
Name Lercanidipine-A 1
Classification Pharmaceutical drug artifact
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 332.100836237 u
Formula C16H16N2O6
InChI InChI=1S/C16H16N2O6/c1-8-12(15(19)20)14(13(9(2)17-8)16(21)24-3)10-5-4-6-11(7-10)18(22)23/h4-7,14,17H,1-3H3,(H,19,20)
InChIKey JPXPPUOCSLMCHK-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 332.312 g/mol
Nominal Mass 332 u
Quality 905
SMILES OC(C=1C(C(=C(NC1C)C)C(OC)=O)C1=CC(=CC=C1)[N+](=O)[O-])=O
SPLASH splash10-03di-1391000000-738fa24fa258d0bed896
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1,4-Dihydro-2,6-dimethyl-5-methoxycarbonyl-4-(3-nitophenyl)pyridine-3-carboxylic acid
Technique DI/MS
Wiley ID DD2024_001814