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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 JGRQQ6glats
Name Nisoldipine
CAS Registry Number 63675-72-9
Classification Pharmaceutical drug, coronary vasodilator
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 388.163436495 u
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
Ionization Type Electron Ionization (EI)
Molecular Weight 388.420 g/mol
Nominal Mass 388 u
Quality 922
Retention Index 2989
SMILES C1(C(=C(NC(=C1C(OC)=O)C)C)C(OCC(C)C)=O)C1=C([N+](=O)[O-])C=CC=C1
SPLASH splash10-00di-2295000000-bbd95a04daf74cdef7ed
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms (RS)Isobutyl-1,4-dihydro-5-methoxycarbonyl-2,6-dimethyl-4-(2-nitrophenyl)-3-\rpyridinecarboxylate
Technique GC/MS
Wiley ID DD2024_011837