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Nisoldipine
SpectraBase Compound ID ApR54LMrOGW
InChI InChI=1S/C20H24N2O6/c1-11(2)10-28-20(24)17-13(4)21-12(3)16(19(23)27-5)18(17)14-8-6-7-9-15(14)22(25)26/h6-9,11,18,21H,10H2,1-5H3
InChIKey VKQFCGNPDRICFG-UHFFFAOYSA-N
Mol Weight 388.42 g/mol
Molecular Formula C20H24N2O6
Exact Mass 388.163436 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IAcs7wxEHAv
Name 4-(2-nitrophenyl)-2,6-dimethyl-3-carbomethoxy-5-carbisobutoxy-1,4-dihydropyridine
Alternate Name(s) Nisoldipine 3-isobutyl 5-methyl 2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H24N2O6
InChI InChI=1S/C20H24N2O6/c1-11(2)10-28-20(24)17-13(4)21-12(3)16(19(23)27-5)18(17)14-8-6-7-9-15(14)22(25)26/h6-9,11,18,21H,10H2,1-5H3
InChIKey VKQFCGNPDRICFG-UHFFFAOYSA-N
Literature Reference DOI 10.1002/rcm.846
Molecular Weight 388.420 g/mol
SMILES N1C(=C(C(C(=C1C)C(=O)OCC(C)C)c1ccccc1[N+]([O-])=O)C(OC)=O)C
SPLASH splash10-00di-1494000000-21941ee50087216c14bf
Source of Spectrum RCM-16-2232-Fig2(d)
Wiley ID 1819802