Name | Value |
---|---|
InChI=1S/C17H26O4/c1-3-4-5-6-14(18)12-15(19)9-7-13-8-10-16(20)17(11-13)21-2/h8,10-11,14,18,20H,3-7,9,12H2,1-2H3/t14-/m1/s1 | |
C17H26O4 | |
294.183109312 | |
O=C(CCC1=CC=C(O)C(OC)=C1)CC(O)CCCCC | |
NLDDIKRKFXEWBK-CQSZACIVSA-N |
Name | Value |
---|---|
LC-ESI | |
Commercial | |
qTof | |
294.185 | |
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 | |
1.6525955486000306 | |
0.4393798515810407 | |
312.219 | |
[M+NH4]+ | |
8.613543698588272 ppm | |
-0.002689312000029531 Da |