Name | Value |
---|---|
InChI=1S/C21H23NO5/c1-22-7-6-14-9-19(24-2)20(25-3)10-15(14)17(23)8-13-4-5-18-21(16(13)11-22)27-12-26-18/h4-5,9-10H,6-8,11-12H2,1-3H3 | |
XPOJSWHIKCNLEQ-UHFFFAOYSA-N | |
C21H23NO5 | |
369.15762283600003 | |
O=C1C2=CC(OC)=C(OC)C=C2CCN(C)CC3=C4OCOC4=CC=C3C1 |
External Identifier | Value |
---|---|
482-74-6 | |
65491 | |
72616 |
Name | Value |
---|---|
BML00804 | |
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 0.612 | |
369.157623 | |
Agilent 1200 RRLC; Agilent 6520 QTOF | |
LC-ESI-QTOF | |
MS2 | |
40 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 | |
4.487 | |
water with 0.2% acetic acid | |
methanol with 0.2% acetic acid | |
positive | |
2.4219282630569157 | |
0.8548344120070825 | |
370.1649 | |
[M+H]+ | |
1.8716955606583778 ppm | |
-6.928360000415523E-4 Da |