Name | Value |
---|---|
InChI=1S/C18H21NO3/c1-19-8-7-18-11-4-5-13(20)17(18)22-16-14(21-2)6-3-10(15(16)18)9-12(11)19/h3-6,11-13,17,20H,7-9H2,1-2H3/t11-,12+,13-,17-,18-/m0/s1 | |
OROGSEYTTFOCAN-DNJOTXNNSA-N | |
C18H21NO3 | |
299.152143532 | |
OC1C=CC2C3N(C)CCC42C5=C(OC14)C(OC)=CC=C5C3 |
External Identifier | Value |
---|---|
76-57-3 | |
16714 | |
C06174 | |
5284371 | |
4447447 |
Name | Value |
---|---|
AU162308 | |
2016.02.26 | |
Nikiforos Alygizakis, Nikolaos Thomaidis, University of Athens | |
CC BY | |
Copyright (C) 2016 Department of Chemistry, University of Athens | |
299.1521435 | |
Bruker maXis Impact | |
LC-ESI-QTOF | |
MS2 | |
ESI | |
CID | |
20 eV | |
35000 | |
ACQUITY UPLC BEH Amide 1.7 um 2.1x100 mm, Waters | |
0/100 at 0-2 min, 95/5 at 12 min, 95/5 at 17 min, 0/100 at 17.1, 0/100 at 25 min | |
200 uL/min | |
6.331 min | |
Water with 0.01% formic acid and 1mM ammonium formate | |
Acetonitrile:Water 95:5 with 0.01% formic acid and 1mM ammonium formate | |
identity on assigned fragments and MS1 | |
RMassBank 1.99.10 | |
positive | |
0.7217702799274008 | |
0.3709165504264422 | |
300.1594 | |
[M+H]+ | |
2.377176926727008 ppm | |
-7.135320000202228E-4 Da |