Name | Value |
---|---|
InChI=1S/C8H7NO/c10-8-5-6-3-1-2-4-7(6)9-8/h1-4H,5H2,(H,9,10) | |
JYGFTBXVXVMTGB-UHFFFAOYSA-N | |
C8H7NO | |
133.052763844 | |
OC1=NC=2C=CC=CC2C1 |
Name | Value |
---|---|
1.037585 | |
30 | |
C8H7NO | |
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 | |
2.1465768199559583 | |
0.8133877183596092 | |
134.060043334961 | |
[M+H]+ | |
5.1507445606158315 ppm | |
-6.905090390034729E-4 Da |