Name | Value |
---|---|
PVNIIMVLHYAWGP-UHFFFAOYSA-N | |
C6H5NO2 | |
123.0320284 | |
O=C(O)C=1C=NC=CC1 | |
InChI=1S/C6H5NO2/c8-6(9)5-2-1-3-7-4-5/h1-4H,(H,8,9) |
Name | Value |
---|---|
M + 0 | |
416 | |
4.007216 | |
positive | |
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) | |
0.65722796959354 | |
0.24269416029512306 | |
124.0394 | |
[M+H]+ | |
4.824273577598894 ppm | |
-5.984000000012202E-4 Da |