Name | Value |
---|---|
XUJNEKJLAYXESH-REOHCLBHSA-N | |
C3H7NO2S | |
121.019749464 | |
O=C(O)C(N)CS | |
InChI=1S/C3H7NO2S/c4-2(1-7)3(5)6/h2,7H,1,4H2,(H,5,6)/t2-/m0/s1 |
Name | Value |
---|---|
MS2 | |
LC-ESI-QTOF | |
Agilent qTOF 6545 | |
C3H7NO2S | |
positive | |
40 eV | |
Sonnenburg Lab MS2 Library C18 positive method | |
Sonnenburg_Lab_qTOF_MS2_Spectra.msp | |
1.2929877891920756 | |
0.5615374620144034 | |
122.0270255 | |
[M+H]+ | |
5.686969727922982 ppm | |
-6.939640000069858E-4 Da |