Name | Value |
---|---|
InChI=1S/C21H18O11/c22-9-3-1-8(2-4-9)13-7-12(24)15-11(23)5-10(6-14(15)31-13)30-21-18(27)16(25)17(26)19(32-21)20(28)29/h1-7,16-19,21-23,25-27H,(H,28,29)/t16-,17-,18+,19-,21+/m0/s1 | |
C21H18O11 | |
446.084911396 | |
O=C(O)C1OC(OC2=CC(O)=C3C(=O)C=C(OC3=C2)C=4C=CC(O)=CC4)C(O)C(O)C1O | |
JBFOLLJCGUCDQP-ZFORQUDYSA-N |
Name | Value |
---|---|
35 | |
MX_C3_105_p10_B04_iTree_NEG_01.raw | |
negative | |
Linear Ion Trap | |
Thermo Finnigan LTQ | |
Arpana Vaniya | |
direct infusion | |
3.50 kV | |
275 C | |
ESI Ion Max | |
0.0 | |
NaN | |
445.11387903550093 | |
M-H | |
81.42554345746055 ppm | |
0.03624363950092402 Da |