Name | Value |
---|---|
KXDAEFPNCMNJSK-UHFFFAOYSA-N | |
C7H7NO | |
121.052763844 | |
N=C(O)C=1C=CC=CC1 | |
InChI=1S/C7H7NO/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H2,8,9) |
Name | Value |
---|---|
M + 0 | |
97 | |
positive | |
HCD (NCE 20-30-40%) | |
1.26575 | |
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) | |
1.2517546313499477 | |
0.6019667330194541 | |
122.0603 | |
[M+H]+ | |
3.5543415836254257 ppm | |
-4.338439999997945E-4 Da |