Name | Value |
---|---|
KSMRODHGGIIXDV-UHFFFAOYSA-N | |
C7H12N2O4 | |
188.079706864 | |
O=C(O)C(N=C(O)C)CCC(=N)O | |
InChI=1S/C7H12N2O4/c1-4(10)9-5(7(12)13)2-3-6(8)11/h5H,2-3H2,1H3,(H2,8,11)(H,9,10)(H,12,13) |
Name | Value |
---|---|
MS2 | |
LC-ESI-QTOF | |
Agilent qTOF 6545 | |
C7H12N2O4 | |
positive | |
10 eV | |
Sonnenburg Lab MS2 Library C18 positive method | |
Sonnenburg_Lab_qTOF_MS2_Spectra.msp | |
1.2466897189289816 | |
0.44964826875652436 | |
189.0869829 | |
[M+H]+ | |
3.670078126741187 ppm | |
-6.939639999927749E-4 Da |