Name | Value |
---|---|
InChI=1S/C6H13NO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1,7H2/t2-,3-,4+,5-,6?/m1/s1 | |
MSWZFWKMSRAUBD-GASJEMHNSA-N | |
C6H13NO5 | |
179.079372516 | |
OCC1OC(O)C(N)C(O)C1O |
Name | Value |
---|---|
Thermo Scientific Orbitrap ID-X | |
LC-ESI-Orbitrap | |
Flow Injection | |
ESI | |
MS2 | |
HCD (NCE 40%) | |
C6H13NO5 | |
179.0 | |
179.07936999999998 | |
IROA_DB_for_mona_filtered_exported_addedInfo.msp | |
positive | |
2.5827204946215163 | |
0.5963702430246507 | |
180.08666999999997 | |
[M+H]+ | |
3.7344018856984196 ppm | |
-6.725160000371488E-4 Da |