Name | Value |
---|---|
ILEDWLMCKZNDJK-UHFFFAOYSA-N | |
C9H6O4 | |
178.026608672 | |
O=C1OC=2C=C(O)C(O)=CC2C=C1 | |
InChI=1S/C9H6O4/c10-6-3-5-1-2-9(12)13-8(5)4-7(6)11/h1-4,10-11H |
Name | Value |
---|---|
M + 0 | |
negative | |
HCD (NCE 20-30-40%) | |
1.457217 | |
175 | |
LC-ESI-QFT | |
Thermo Q Exactive HF | |
Michael Sa and Megan Showalter | |
MS2 | |
Waters Acquity UPLC BEH Amide column (2.1 x 150mm: 1.7µm) | |
0.7607927303875639 | |
0.29661120917432093 | |
177.0185 | |
[M-H]- | |
4.703869934666649 ppm | |
-8.326720000297883E-4 Da |