SpectraBase Compound ID | HQsNX32x7Jx |
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InChI | InChI=1S/C12H16N4O6/c1-14-9-6(10(20)15(2)12(14)21)16(4-13-9)11-8(19)7(18)5(17)3-22-11/h4-5,7-8,11,17-19H,3H2,1-2H3/t5-,7-,8-,11-/m1/s1 |
InChIKey | IAXVIPLJJWNIOX-IOSLPCCCSA-N |
Mol Weight | 312.28 g/mol |
Molecular Formula | C12H16N4O6 |
Exact Mass | 312.106984 g/mol |
SpectraBase Spectrum ID | 43IfrwNRszx |
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Name | (-)-7-(beta-D-ribopyranosyl)theophylline |
Conditions | Neutral |
Copyright | Copyright © 2008-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C12H16N4O6 |
InChI | InChI=1S/C12H16N4O6/c1-14-9-6(10(20)15(2)12(14)21)16(4-13-9)11-8(19)7(18)5(17)3-22-11/h4-5,7-8,11,17-19H,3H2,1-2H3/t5-,7-,8-,11-/m1/s1 |
InChIKey | IAXVIPLJJWNIOX-IOSLPCCCSA-N |
Sadtler IR Number | 30854 |
Sadtler UV Number | 12986N |
Solvent | Methanol |