Name | Value |
---|---|
MSWZFWKMSRAUBD-CBPJZXOFSA-N | |
C6H13NO5 | |
179.07937251599998 | |
OCC1OC(O)C(N)C(O)C1O | |
InChI=1S/C6H13NO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1,7H2/t2-,3+,4-,5-,6?/m1/s1 |
Name | Value |
---|---|
MS2 | |
LC-ESI-QFT | |
Thermo Q Exactive HF | |
C6H13NO5 | |
positive | |
HCD (NCE 20-30-40%) | |
Sonnenburg Lab MS2 Library C18 positive method | |
Sonnenburg_Lab_QE_MS2_Spectra.msp | |
2.4759843180871495 | |
0.7210231636429091 | |
180.0866485 | |
[M+H]+ | |
3.85378930511257 ppm | |
-6.940159999828666E-4 Da |