Name | Value |
---|---|
InChI=1S/C4H9NO3/c5-2-3(6)1-4(7)8/h3,6H,1-2,5H2,(H,7,8) | |
YQGDEPYYFWUPGO-UHFFFAOYSA-N | |
C4H9NO3 | |
119.058243148 | |
O=C(O)CC(O)CN |
Name | Value |
---|---|
30 | |
9.369312 | |
C4H9NO3 | |
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 | |
1.3159112578730223 | |
0.7344240566173524 | |
120.065521240234 | |
[M+H]+ | |
5.7627515280831405 ppm | |
-6.919077659972572E-4 Da |