Name | Value |
---|---|
RILPIWOPNGRASR-RFZPGFLSSA-N | |
C6H12O3 | |
132.078644244 | |
O=C(O)C(O)C(C)CC | |
InChI=1S/C6H12O3/c1-3-4(2)5(7)6(8)9/h4-5,7H,3H2,1-2H3,(H,8,9)/t4-,5-/m1/s1 |
Name | Value |
---|---|
MS2 | |
LC-ESI-QFT | |
Thermo Q Exactive HF | |
C6H12O3 | |
negative | |
HCD (NCE 20-30-40%) | |
Sonnenburg Lab MS2 Library C18 negative method | |
Sonnenburg_Lab_QE_MS2_Spectra.msp | |
0.8366625389691302 | |
0.4023496319561111 | |
131.0713682 | |
[M-H]- | |
3.356951137054739E-4 ppm | |
-4.400001785143104E-8 Da |