Name | Value |
---|---|
FCCDDURTIIUXBY-UHFFFAOYSA-N | |
C8H15NOS2 | |
205.0595061 | |
N=C(O)CCCCC1SSCC1 | |
InChI=1S/C8H15NOS2/c9-8(10)4-2-1-3-7-5-6-11-12-7/h7H,1-6H2,(H2,9,10) |
Name | Value |
---|---|
[M+H]+ | |
MS2 | |
LC-ESI-QFT | |
Thermo Q Exactive HF | |
C8H15NOS2 | |
positive | |
HCD (NCE 20-30-40%) | |
Sonnenburg Lab MS2 Library C18 positive method | |
Sonnenburg_Lab_QE_MS2_Spectra.msp | |
2.0275980589376386 | |
0.622325960963981 | |
206.0667821 | |
3.3678402356220554 ppm | |
-6.939999999815427E-4 Da |