Name | Value |
---|---|
C7H11N3O2 | |
169.085126592 | |
InChI=1S/C7H11N3O2/c1-10-4-9-3-5(10)2-6(8)7(11)12/h3-4,6H,2,8H2,1H3,(H,11,12)/t6-/m0/s1 | |
JDHILDINMRGULE-LURJTMIESA-N | |
O=C(O)C(N)CC1=CN=CN1C |
Name | Value |
---|---|
Thermo Scientific Orbitrap ID-X | |
LC-ESI-Orbitrap | |
Flow Injection | |
ESI | |
MS2 | |
HCD (NCE 40%) | |
C7H11N3O2 | |
169.0 | |
169.08513 | |
IROA_DB_for_mona_filtered_exported_addedInfo.msp | |
negative | |
1.7200265520662472 | |
0.5343562925844383 | |
168.07783 | |
[M-H]- | |
0.12251467072419456 ppm | |
-2.0591999998487154E-5 Da |