SpectraBase Compound ID | DPp7wbsWHp3 |
---|---|
InChI | InChI=1S/C7H7BrN4O2.C2H7N/c1-11-4-3(9-6(8)10-4)5(13)12(2)7(11)14;1-2-3/h1-2H3,(H,9,10);2-3H2,1H3 |
InChIKey | MCMGCJPMYLYHQJ-UHFFFAOYSA-N |
Mol Weight | 304.15 g/mol |
Molecular Formula | C9H14BrN5O2 |
Exact Mass | 303.033088 g/mol |
SpectraBase Spectrum ID | 2jCc2cKG4rk |
---|---|
Name | 8-bromotheophylline, compd. with ethylamine(1:1) |
Conditions | Neutral |
Copyright | Copyright © 2008-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C9H14BrN5O2 |
InChI | InChI=1S/C7H7BrN4O2.C2H7N/c1-11-4-3(9-6(8)10-4)5(13)12(2)7(11)14;1-2-3/h1-2H3,(H,9,10);2-3H2,1H3 |
InChIKey | MCMGCJPMYLYHQJ-UHFFFAOYSA-N |
Sadtler IR Number | 9559 |
Sadtler UV Number | 15888N |
Solvent | Methanol |