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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 9V0QQLIl60l
Name .beta.-diethylaminoethyl 9-xanthenecarboxylate methobromide
CAS Registry Number 53-46-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. 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
Molecular Weight 420.347 g/mol
SMILES [Br-].c1ccc2Oc3c(cccc3)C(C(OCC[N+](CC)(C)CC)=O)c2c1
SPLASH splash10-001r-9800000000-cfc6a359aa3bb8d39368
Source of Spectrum JZ-1992-5522-0
Synonyms .beta.-Diethylaminoethyl xanthene-9-carboxylate methobromide Ammonium, diethyl(2-hydroxyethyl)methyl-, bromide, xanthene-9-carboxylate Asabaine Avagal Banthin Banthine Banthine bromide Bromure de methanthelinum Bromuro de metantelinio Diethyl(2-hydroxyethyl)methylammonium bromide xanthene-9-carboxylate Diethyl-methyl-[2-(9H-xanthene-9-carbonyloxy)ethyl]azanium bromide Dixamone bromide Doladene Frenogastrico Gastron Gastrosedan Mantheline Metantelinio bromuro Metantyl Metaxan Methanide Methantheline bromide Methanthelinii bromidum Methanthelinium bromide Methanthine bromide Methelina MTB 51 N,N-diethyl-N-methyl-2-[(9H-xanthen-9-ylcarbonyl)oxy]ethanaminium bromide Resobantin Ulcine Ulcudexter Vagamin Vagantin Xanteline Xanthene-9-carboxylic acid, ester with diethyl(2-hydroxyethyl)methylammonium bromide Diethyl-methyl-[2-[oxo(9H-xanthen-9-yl)methoxy]ethyl]ammonium;bromide Diethyl-methyl-[2-(9H-xanthene-9-carbonyloxy)ethyl]azanium;bromide Diethyl-methyl-[2-(9H-xanthen-9-ylcarbonyloxy)ethyl]azanium;bromide EINECS 200-176-0 NSC 32145 SC 2910
Wiley ID 1377578