Name | Value |
---|---|
BLFLLBZGZJTVJG-UHFFFAOYSA-N | |
C9H11NO2 | |
165.078978592 | |
O=C(OCC)C1=CC=C(N)C=C1 | |
InChI=1S/C9H11NO2/c1-2-12-9(11)7-3-5-8(10)6-4-7/h3-6H,2,10H2,1H3 |
Name | Value |
---|---|
MS2 | |
LC-ESI-QFT | |
Thermo Q Exactive HF | |
C9H11NO2 | |
positive | |
HCD (NCE 20-30-40%) | |
Sonnenburg Lab MS2 Library C18 positive method | |
Sonnenburg_Lab_QE_MS2_Spectra.msp | |
1.2838548191073047 | |
0.6174036602491686 | |
166.0862546 | |
[M+H]+ | |
4.178503523248832 ppm | |
-6.939920000093025E-4 Da |