Name | Value |
---|---|
InChI=1S/C19H14O10/c1-6-3-9(26-2)7(4-20)14-10(6)17(23)28-15-8(5-21)13(22)11-12(16(15)27-14)19(25)29-18(11)24/h3-4,19,21-22,25H,5H2,1-2H3 | |
C19H14O10 | |
402.058696648 | |
O=CC1=C(OC)C=C(C=2C(=O)OC3=C(OC12)C4=C(C(=O)OC4O)C(O)=C3CO)C | |
FYPCEUKJORJHDL-UHFFFAOYSA-N |
Name | Value |
---|---|
LC-ESI | |
Isolated | |
Orbitrap | |
402.059 | |
1 | |
POS_086_Constictic_acid_Comp_2MpNH4_@113.616_merged.mzXML | |
MS2 | |
LDB_POSITIVE | |
Damien OLIVIER, mpanitchpakdi, Jean-Luc WOLFENDER Pierre-Marie ALLARD | |
positive | |
2.356813949002886 | |
0.5319141043290582 | |
822.152 | |
[2M+NH4]+ | |
4.832799774283215 ppm | |
-0.003973296000026494 Da |