Name | Value |
---|---|
OOGPWQHGQYUIAW-JEWCKWPLSA-N | |
C31H32O16 | |
660.169034944 | |
O=C(OC1CC(O)(C(=O)O)CC(OC(=O)C=CC2=CC=C(O)C(O)=C2)C1OC(=O)CC(O)(C)CC(=O)O)C=CC3=CC=C(O)C(O)=C3 | |
InChI=1S/C31H32O16/c1-30(43,14-24(36)37)15-27(40)47-28-22(45-25(38)8-4-16-2-6-18(32)20(34)10-16)12-31(44,29(41)42)13-23(28)46-26(39)9-5-17-3-7-19(33)21(35)11-17/h2-11,22-23,28,32-35,43-44H,12-15H2,1H3,(H,36,37)(H,41,42)/b8-4+,9-5+/t22-,23-,28-,30?,31+/m1/s1 |
Name | Value |
---|---|
MS2 | |
LC-ESI-QTOF | |
Agilent 6530 Q-TOF | |
Arpana Vaniya and Alberto Valdes Tabernero | |
negative | |
20 V | |
MX_C2_849 | |
3.028 minutes | |
1.7036312025872984 | |
0.6013070657602745 | |
659.1636 | |
[M-H]- | |
2.7930183037857277 ppm | |
0.001841055999989294 Da |