SpectraBase Compound ID | 6EoCoxCcCDN |
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InChI | InChI=1S/C7H7BrN4O2.C4H11N/c1-11-4-3(9-6(8)10-4)5(13)12(2)7(11)14;1-2-3-4-5/h1-2H3,(H,9,10);2-5H2,1H3 |
InChIKey | WEOWJDGPYDHMRC-UHFFFAOYSA-N |
Mol Weight | 332.2 g/mol |
Molecular Formula | C11H18BrN5O2 |
Exact Mass | 331.064388 g/mol |
SpectraBase Spectrum ID | Bv48n4S3T7m |
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Name | 8-bromotheophylline, compd. with butylamine |
Conditions | Neutral |
Copyright | Copyright © 2008-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C11H18BrN5O2 |
InChI | InChI=1S/C7H7BrN4O2.C4H11N/c1-11-4-3(9-6(8)10-4)5(13)12(2)7(11)14;1-2-3-4-5/h1-2H3,(H,9,10);2-5H2,1H3 |
InChIKey | WEOWJDGPYDHMRC-UHFFFAOYSA-N |
Sadtler IR Number | 9557 |
Sadtler UV Number | 15887N |
Solvent | Methanol |