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Methantheline bromide
SpectraBase Compound ID KoM4wBRPlo1
InChI InChI=1S/C21H26NO3.BrH/c1-4-22(3,5-2)14-15-24-21(23)20-16-10-6-8-12-18(16)25-19-13-9-7-11-17(19)20;/h6-13,20H,4-5,14-15H2,1-3H3;1H/q+1;/p-1
InChIKey PQMWYJDJHJQZDE-UHFFFAOYSA-M
Mol Weight 420.35 g/mol
Molecular Formula C21H26BrNO3
Exact Mass 419.109607 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4m4dGceDwzm
Name Methantheline bromide
Copyright Copyright © 2012-2024 John Wiley & Sons, Inc. Portions provided by AAFS, Toxicology Section. All Rights Reserved.
Formula C21H26BrNO3
InChI InChI=1S/C21H26NO3.BrH/c1-4-22(3,5-2)14-15-24-21(23)20-16-10-6-8-12-18(16)25-19-13-9-7-11-17(19)20;/h6-13,20H,4-5,14-15H2,1-3H3;1H/q+1;/p-1
InChIKey PQMWYJDJHJQZDE-UHFFFAOYSA-M
SMILES C([N+](CCOC(C1c2c(Oc3c1cccc3)cccc2)=O)(CC)C)C.[Br-]
SPLASH splash10-001r-9700000000-184d00707f7e50ae4add
Source of Spectrum Mass Spectrometry Committee of the Toxicology Section of the American Academy of Forensic Sciences