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 |
---|---|
MS2 | |
LC-ESI-QFT | |
Thermo Q Exactive HF | |
C6H5NO2 | |
negative | |
HCD (NCE 20-30-40%) | |
Sonnenburg Lab MS2 Library C18 negative method | |
Sonnenburg_Lab_QE_MS2_Spectra.msp | |
0.6770697869729423 | |
0.32560174133387026 | |
122.0247524 | |
[M-H]- | |
0.0 ppm | |
0.0 Da |