Name | Value |
---|---|
InChI=1S/C21H16O6/c1-23-16-7-12-5-13-9-25-21(22)20(13)19(14(12)8-17(16)24-2)11-3-4-15-18(6-11)27-10-26-15/h3-8H,9-10H2,1-2H3 | |
RTDRYYULUYRTAN-UHFFFAOYSA-N | |
C21H16O6 | |
364.09468823199995 | |
O=C1OCC=2C=C3C=C(OC)C(OC)=CC3=C(C=4C=CC=5OCOC5C4)C12 |
External Identifier | Value |
---|---|
17951-19-8 | |
391190 | |
442882 |
Name | Value |
---|---|
BML01595 | |
2016.01.19 (Created 2012.10.26) | |
Cuthbertson DJ, Johnson SR, Lange BM, Institute of Biological Chemistry, Washington State University | |
CC BY-SA | |
relative retention time with respect to 9-anthracene Carboxylic Acid is 1.209 | |
364.094688 | |
Agilent 1200 RRLC; Agilent 6520 QTOF | |
LC-ESI-QTOF | |
MS2 | |
10 ev | |
N2 | |
m/z 100-1000 | |
Agilent C8 Cartridge Column 2.1X30mm 3.5 micron (guard); Agilent SB-Aq 2.1x50mm 1.8 micron (analytical) | |
60 C | |
linear from 98A/2B at 0 min to 2A/98B at 13 min, hold 6 min at 2A/98B, reequilibration 98A/2B (5 min) | |
0.6 ml/min | |
8.922 | |
water with 0.2% acetic acid | |
methanol with 0.2% acetic acid | |
positive | |
0.8563743053946753 | |
0.3897527427227721 | |
365.102 | |
[M+H]+ | |
1.8028715262527812 ppm | |
-6.582319999779429E-4 Da |