Name | Value |
---|---|
InChI=1S/C8H8O4/c1-4(9)8-6(11)2-5(10)3-7(8)12/h2-3,10-12H,1H3 | |
C8H8O4 | |
168.042258736 | |
O=C(C=1C(O)=CC(O)=CC1O)C | |
XLEYFDVVXLMULC-UHFFFAOYSA-N |
Name | Value |
---|---|
LC-ESI | |
Isolated | |
Orbitrap | |
168.042 | |
1 | |
NEG_001_2_4_6_Trihydroxyacetophenone_Comp_2MmH_@92.9927_merged.mzXML | |
MS2 | |
LDB_NEGATIVE | |
Damien OLIVIER, mpanitchpakdi, Jean-Luc WOLFENDER Pierre-Marie ALLARD | |
negative | |
1.5655705073889388 | |
0.3487853277547552 | |
335.077 | |
[2M-H]- | |
0.7206462992907388 ppm | |
-2.4147200002744285E-4 Da |