Name | Value |
---|---|
InChI=1S/C11H12O5/c1-6(12)11-7(4-10(14)15)3-8(16-2)5-9(11)13/h3,5,13H,4H2,1-2H3,(H,14,15) | |
C11H12O5 | |
224.06847348399998 | |
O=C(O)CC1=CC(OC)=CC(O)=C1C(=O)C | |
UYUOIPIOTPMHKV-UHFFFAOYSA-N |
Name | Value |
---|---|
LC-ESI | |
Commercial | |
qTof | |
224.068 | |
1 | |
20200308_MSV000080492_NIH_Part1_TOF_Pos_IIN_robin_exportMerged_0i04min_200noise_mergeMSMSsum.mgf | |
MS2 | |
GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE | |
Pieter Dorrestein, mpanitchpakdi, lfnothias/robinschmid | |
positive | |
2.0603290175319526 | |
0.9908088187309928 | |
356.084 | |
[3M+Ca]2+ |