Adenosine 5'-monophosphate(61-19-8) IR1
Product NameAdenosine 5'-monophosphate
CAS61-19-8
Molecular FormulaC10H14N5O7P
Molecular Weight347.22
InChIInChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/t4-,6-,7-,10-/m1/s1
InChIKey UDMBCSSLTHHNCD-KQYNXXCUSA-N
SmilesP(OC[C@H]1O[C@@H](N2C3C(=C(N=CN=3)N)N=C2)[C@H](O)[C@@H]1O)(O)(O)=O
400 MHz in D2O
-
1H NMR 399.65 MHz C10 H14 N5 O7 P saturated in D2O adenosine 5'-monophosphate 
Assign. Shift(ppm)
A 8.577 B 8.349 C 6.162 D 4.750 E 4.510 F 4.398 G 4.15 THE SOLVENT PEAK SUPPRESSED.
Hz ppm Int.3427.61 8.577 541 3341.06 8.360 134 3340.21 8.358 171 3336.67 8.349 689 2465.58 6.170 906 2460.08 6.156 1000 1905.15 4.768 216 1899.90 4.754 363 1894.65 4.741 282 1807.25 4.523 506 1805.42 4.518 174 1803.34 4.513 654 1802.25 4.510 608 1798.46 4.501 560 1760.50 4.406 376 1758.06 4.399 472 1755.00 4.392 370 1674.44 4.190 115 1674.07 4.189 132 1673.58 4.188 111 1672.97 4.187 127 1672.61 4.186 127 1670.17 4.180 115 1669.56 4.178 120 1665.41 4.168 346 1662.60 4.161 417 1660.89 4.156 453 1658.45 4.150 586 1655.76 4.144 409 1654.42 4.140 344 1653.56 4.138 388 1650.27 4.130 329 1646.97 4.122 137 1643.92 4.114 119 1641.97 4.109 124 1641.48 4.108 126
in CDCl3
KBr disc
nujol mull
