Name | Value |
---|---|
C9H14N2O7 | |
262.080100788 | |
O=C1NC(=O)C(O)C(O)N1C2OC(CO)C(O)C2 | |
InChI=1S/C9H14N2O7/c12-2-4-3(13)1-5(18-4)11-8(16)6(14)7(15)10-9(11)17/h3-6,8,12-14,16H,1-2H2,(H,10,15,17)/t3-,4+,5+,6?,8?/m0/s1 | |
ORRZKGUUIZYKRN-QUOQFLJZSA-N |
Name | Value |
---|---|
ESI-ITFT | |
LTQ Orbitrap Fusion Tribrid, Thermo Scientfic | |
hcd | |
60 | |
C9H14N2O7 | |
2 | |
20231130_DNA-Adduct_CombinedDB.msp | |
1.6683043776060185 | |
0.9310984014638836 | |
positive | |
263.087380904 | |
[M+H]+ | |
2.622261841771848 ppm | |
-6.898839999962547E-4 Da |