Name | Value |
---|---|
InChI=1S/C14H14O4/c1-14(2,16)11-7-9-10(17-11)5-3-8-4-6-12(15)18-13(8)9/h3-6,11,16H,7H2,1-2H3 | |
C14H14O4 | |
246.089208928 | |
O=C1OC2=C(C=C1)C=CC=3OC(CC32)C(O)(C)C | |
YRAQEMCYCSSHJG-UHFFFAOYSA-N |
Name | Value |
---|---|
LC-ESI | |
Commercial | |
qTof | |
246.09 | |
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 | |
1.7955033872993613 | |
0.3743915357078937 | |
493.188 | |
[2M+H]+ | |
3.26882243683522 ppm | |
0.0016121439999778886 Da |