Name | Value |
---|---|
Anthracenecarboxylic acids | |
C42H38O20 | |
862.195643616 | |
O=C(O)C1=CC(O)=C2C(=O)C=3C(OC4OC(CO)C(O)C(O)C4O)=CC=CC3C(C2=C1)C5C=6C=CC=C(OC7OC(CO)C(O)C(O)C7O)C6C(=O)C8=C(O)C=C(C=C85)C(=O)O | |
InChI=1S/C42H38O20/c43-11-23-31(47)35(51)37(53)41(61-23)59-21-5-1-3-15-25(17-7-13(39(55)56)9-19(45)27(17)33(49)29(15)21)26-16-4-2-6-22(60-42-38(54)36(52)32(48)24(12-44)62-42)30(16)34(50)28-18(26)8-14(40(57)58)10-20(28)46/h1-10,23-26,31-32,35-38,41-48,51-54H,11-12H2,(H,55,56)(H,57,58) | |
IPQVTOJGNYVQEO-UHFFFAOYSA-N |
Name | Value |
---|---|
MS2 | |
LC-ESI-QTOF | |
10 eV | |
3.824933 | |
Waters Xevo G2 Q-Tof | |
Waters Acquity UPLC BEH C18 (1.7um x 2.1mm x 150 mm) | |
negative | |
0.20494473544620972 | |
0.11438183470826373 | |
861.18836714783 | |
[M-H]- | |
5.43632402536319E-4 ppm | |
-4.6816990106890444E-7 Da |