Name | Value |
---|---|
InChI=1S/C20H22O7/c1-10(2)19(23)26-17-13-8-12-6-7-16(22)24-14(12)9-15(13)25-18(17)20(4,5)27-11(3)21/h6-10,17-18H,1-5H3 | |
C20H22O7 | |
374.136553044 | |
O=C1OC=2C=C3OC(C(OC(=O)C(C)C)C3=CC2C=C1)C(OC(=O)C)(C)C | |
IAFDNCWNSBMBIV-UHFFFAOYSA-N |
Name | Value |
---|---|
LC-ESI | |
Commercial | |
qTof | |
374.136 | |
1 | |
MS2 | |
20200308_MSV000080492_NIH_Part1_TOF_Pos_IIN_robin_exportMerged_0i04min_200noise_mergeMSMSsum.mgf | |
GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE | |
Pieter Dorrestein, mpanitchpakdi, lfnothias/robinschmid | |
positive | |
2.850497289754166 | |
0.7727271452514437 | |
392.169 | |
[M+NH4]+ | |
15.638778179874866 ppm | |
-0.006133044000023347 Da |