For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
8-bromotheophylline, compd. with 2-amino-2-methyl-1-propanol (1:1)
SpectraBase Compound ID 7jm8fDqBMsn
InChI InChI=1S/C7H7BrN4O2.C4H11NO/c1-11-4-3(9-6(8)10-4)5(13)12(2)7(11)14;1-4(2,5)3-6/h1-2H3,(H,9,10);6H,3,5H2,1-2H3
InChIKey ATOTUUBRFJHZQG-UHFFFAOYSA-N
Mol Weight 348.2 g/mol
Molecular Formula C11H18BrN5O3
Exact Mass 347.059302 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID I39oGMsRy0s
Name 8-BROMOTHEOPHYLLINE, COMPOUND WITH 2-AMINO-2-METHYL-1-PROPANOL (1:1)
Source of Sample The Chattanooga Medicine Company, Tennessee
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18BrN5O3
InChI InChI=1S/C7H7BrN4O2.C4H11NO/c1-11-4-3(9-6(8)10-4)5(13)12(2)7(11)14;1-4(2,5)3-6/h1-2H3,(H,9,10);6H,3,5H2,1-2H3
InChIKey ATOTUUBRFJHZQG-UHFFFAOYSA-N
Literature Reference JPSC 44, 355(1955)
Melting Point 295C
Molecular Weight 348.207001
Synonyms THEOPHYLLINE, 8-BROMO-, COMPD WITH 2-AMINO-2-METHYL-1-PROPANOL
Technique KBr WAFER