Name | Value |
---|---|
InChI=1S/C16H11F5N2O4S/c1-3-27-16(26)5-4(2)12(13(22)24)28-15(5)23-14(25)6-7(17)9(19)11(21)10(20)8(6)18/h3H2,1-2H3,(H2,22,24)(H,23,25) | |
ANCBHJKEYPZCTE-UHFFFAOYSA-N | |
C16H11F5N2O4S | |
422.035968932 | |
O=C(OCC)C1=C(N=C(O)C=2C(F)=C(F)C(F)=C(F)C2F)SC(C(=O)N)=C1C |
Name | Value |
---|---|
MS2 | |
LC-ESI-QFT | |
Thermo Q Exactive HF | |
HCD (NCE 20-30-40%) | |
C16H11N2O4F5S | |
422.036 | |
422.33 | |
pathogen_box_qe_rp_pos_proton_sept_2018_dinesh_barupal.msp | |
positive | |
1.8409775457832585 | |
0.5719318314674778 | |
423.043070280122 | |
[M+H]+ | |
2.0533414657924394 ppm | |
-8.686518780223196E-4 Da |