Name | Value |
---|---|
InChI=1S/C9H7N/c1-2-6-9-8(4-1)5-3-7-10-9/h1-7H | |
SMWDFEZZVXVKRB-UHFFFAOYSA-N | |
C9H7N | |
129.057849224 | |
N=1C=CC=C2C=CC=CC12 |
Name | Value |
---|---|
2.293682 | |
0 | |
C9H7N | |
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 | |
0.435419713973281 | |
0.396336103705118 | |
130.065124511719 | |
[M+H]+ | |
5.341264874785533 ppm | |
-6.947122809890516E-4 Da |