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Verapamil
SpectraBase Compound ID KuEqtHFZmfu
InChI InChI=1S/C27H38N2O4/c1-20(2)27(19-28,22-16-23(30-4)18-24(17-22)31-5)12-8-13-29(3)14-11-21-9-10-25(32-6)26(15-21)33-7/h9-10,15-18,20H,8,11-14H2,1-7H3
InChIKey PIRIGFSFDAPYKJ-UHFFFAOYSA-N
Mol Weight 454.6 g/mol
Molecular Formula C27H38N2O4
Exact Mass 454.283158 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6mGDdGvkqSI
Name Verapamil
Copyright Copyright © 2012-2024 John Wiley & Sons, Inc. Portions provided by AAFS, Toxicology Section. All Rights Reserved.
Formula C27H38N2O4
InChI InChI=1S/C27H38N2O4/c1-20(2)27(19-28,22-16-23(30-4)18-24(17-22)31-5)12-8-13-29(3)14-11-21-9-10-25(32-6)26(15-21)33-7/h9-10,15-18,20H,8,11-14H2,1-7H3
InChIKey PIRIGFSFDAPYKJ-UHFFFAOYSA-N
SMILES COc1ccc(CCN(CCCC(c2cc(cc(c2)OC)OC)(C#N)C(C)C)C)cc1OC
SPLASH splash10-0udi-5819000000-c32acdec31b2a7d6af52
Source of Spectrum Mass Spectrometry Committee of the Toxicology Section of the American Academy of Forensic Sciences