Name | Value |
---|---|
WPYMKLBDIGXBTP-UHFFFAOYSA-N | |
C7H6O2 | |
122.036779432 | |
O=C(O)C=1C=CC=CC1 | |
InChI=1S/C7H6O2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9) |
Name | Value |
---|---|
M + 0 | |
negative | |
HCD (NCE 20-30-40%) | |
1.1749 | |
122 | |
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) | |
0.38723815336835654 | |
0.1614908531499148 | |
121.0284 | |
[M-H]- | |
9.117132838190305 ppm | |
-0.0011034319999936315 Da |