Name | Value |
---|---|
InChI=1S/C9H12N2O6/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16/h1-2,4,6-8,12,14-15H,3H2,(H,10,13,16)/t4-,6-,7-,8-/m1/s1 | |
DRTQHJPVMGBUCF-XVFCMESISA-N | |
C9H12N2O6 | |
244.06953610399998 | |
O=C1N=C(O)C=CN1C2OC(CO)C(O)C2O |
Name | Value |
---|---|
Flow Injection | |
Thermo Scientific Orbitrap ID-X | |
LC-ESI-Orbitrap | |
ESI | |
MS2 | |
HCD (NCE 40%) | |
C9H12N2O6 | |
244.0 | |
244.06954 | |
IROA_DB_for_mona_filtered_exported_addedInfo.msp | |
positive | |
1.450142291692454 | |
0.39049795335718773 | |
245.07683999999998 | |
[M+H]+ | |
2.7179394022054373 ppm | |
-6.661040000039975E-4 Da |