Name | Value |
---|---|
KSPQDMRTZZYQLM-UHFFFAOYSA-N | |
C7H7NO4 | |
169.03750770399998 | |
O=C(O)CNC(=O)C=1OC=CC1 | |
InChI=1S/C7H7NO4/c9-6(10)4-8-7(11)5-2-1-3-12-5/h1-3H,4H2,(H,8,11)(H,9,10) |
Name | Value |
---|---|
MS2 | |
LC-ESI-QTOF | |
Agilent qTOF 6545 | |
C7H7NO4 | |
negative | |
20 eV | |
Sonnenburg Lab MS2 Library C18 negative method | |
Sonnenburg_Lab_qTOF_MS2_Spectra.msp | |
1.5998822029286885 | |
0.623748066711169 | |
168.0302317 | |
[M-H]- | |
2.380515743886086E-5 ppm | |
-3.999986120106769E-9 Da |