Name | Value |
---|---|
InChI=1S/C11H19N3O6/c1-2-7(10(18)13-5-9(16)17)14-8(15)4-3-6(12)11(19)20/h6-7H,2-5,12H2,1H3,(H,13,18)(H,14,15)(H,16,17)(H,19,20)/t6-,7-/m0/s1 | |
JCMUOFQHZLPHQP-BQBZGAKWSA-N | |
C11H19N3O6 | |
289.12738532799995 | |
O=C(O)CN=C(O)C(N=C(O)CCC(N)C(=O)O)CC |
Name | Value |
---|---|
Thermo Scientific Orbitrap ID-X | |
LC-ESI-Orbitrap | |
Flow Injection | |
ESI | |
MS2 | |
HCD (NCE 40%) | |
C11H19N3O6 | |
289.0 | |
289.12739 | |
IROA_DB_for_mona_filtered_exported_addedInfo.msp | |
negative | |
3.185717628966708 | |
0.7189910514463959 | |
288.12009 | |
[M-H]- | |
0.06708313866883334 ppm | |
-1.9327999950746744E-5 Da |