Name | Value |
---|---|
ILRYLPWNYFXEMH-WHFBIAKZSA-N | |
C7H14N2O4S | |
222.067427928 | |
O=C(O)C(N)CSCCC(N)C(=O)O | |
InChI=1S/C7H14N2O4S/c8-4(6(10)11)1-2-14-3-5(9)7(12)13/h4-5H,1-3,8-9H2,(H,10,11)(H,12,13)/t4-,5-/m0/s1 |
Name | Value |
---|---|
M + 0 | |
negative | |
HCD (NCE 20-30-40%) | |
1847 | |
9.854466 | |
LC-ESI-QFT | |
Thermo Q Exactive HF | |
Michael Sa and Megan Showalter | |
MS2 | |
Waters Acquity UPLC BEH Amide column (2.1 x 150mm: 1.7µm) | |
1.1577059923756372 | |
0.5268947035806276 | |
221.0597 | |
[M-H]- | |
2.0443708193675394 ppm | |
-4.519280000181425E-4 Da |