Name | Value |
---|---|
InChI=1S/C8H11NO2/c9-4-3-6-1-2-7(10)8(11)5-6/h1-2,5,10-11H,3-4,9H2 | |
VYFYYTLLBUKUHU-UHFFFAOYSA-N | |
C8H11NO2 | |
153.078978592 | |
OC1=CC=C(C=C1O)CCN |
Name | Value |
---|---|
8.49 | |
ESI | |
DDA | |
10 | |
C8H11NO2 | |
Centroid | |
Isabel Meister, Romanas Chaleckis | |
Agilent 6550 iFunnel | |
LC-ESI-QTOF | |
CC-BY | |
MS2 | |
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_V01_RCH_LC02_tDDA_ChemSTD_Meister2020_OPEN.msp | |
positive | |
0.8252714379452601 | |
0.5127699748896349 | |
154.08625793457 | |
[M+H]+ | |
4.482277908859593 ppm | |
-6.906574299989643E-4 Da |