Name | Value |
---|---|
InChI=1S/C5H6N2O2/c8-5(9)1-4-2-6-3-7-4/h2-3H,1H2,(H,6,7)(H,8,9) | |
PRJKNHOMHKJCEJ-UHFFFAOYSA-N | |
C5H6N2O2 | |
126.042927432 | |
O=C(O)CC1=CN=CN1 |
Name | Value |
---|---|
7.666882 | |
30 | |
C5H6N2O2 | |
Centroid | |
Isabel Meister, Romanas Chaleckis | |
Agilent 6550 iFunnel | |
LC-ESI-QTOF | |
CC-BY | |
MS2 | |
ESI | |
AIF | |
Merck SeQuant ZIC HILIC (2.1 x 100 mm, 3.5 µm particle size) with Merck SeQuant ZIC HILIC Guard column (2.1 mm x 2 mm, 3.5 µm particle size) | |
5/95 at 0-1.5 min, 60/40 at 12-14 min, 75/25 at 14.2-17 min; 5/95 at 18-25 min | |
0.3ml/min | |
water with 0.1% formic acid (pH2.7) | |
acetonitrile with 0.1% formic acid | |
POS_2020-06-11_V02-RCH_LC02_AIF_ChemSTD_Meister2020_OPEN.msp | |
positive | |
1.6148926399260617 | |
0.901288743082132 | |
127.050201416016 | |
[M+H]+ | |
5.478275329338253 ppm | |
-6.960159840048163E-4 Da |