Name | Value |
---|---|
RGHHSNMVTDWUBI-UHFFFAOYSA-N | |
C7H6O2 | |
122.036779432 | |
O=CC1=CC=C(O)C=C1 | |
InChI=1S/C7H6O2/c8-5-6-1-3-7(9)4-2-6/h1-5,9H |
Name | Value |
---|---|
M + 0 | |
123 | |
negative | |
1.174517 | |
HCD (NCE 20-30-40%) | |
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) | |
0.38805943183793273 | |
0.16183335287410738 | |
121.0283 | |
[M-H]- | |
9.943393404657845 ppm | |
-0.0012034319999969512 Da |