CID 56947

Brn 5593796

Structural Information

Molecular Formula
C10H15N5O2S
SMILES
C1COCCN1C2=CC(=NC=N2)SCC(=O)NN
InChI
InChI=1S/C10H15N5O2S/c11-14-9(16)6-18-10-5-8(12-7-13-10)15-1-3-17-4-2-15/h5,7H,1-4,6,11H2,(H,14,16)
InChIKey
AVVJNYLWRMYOOC-UHFFFAOYSA-N
Compound name
2-(6-morpholin-4-ylpyrimidin-4-yl)sulfanylacetohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

269.09464 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.10192 158.5
[M+Na]+ 292.08386 163.5
[M-H]- 268.08736 160.6
[M+NH4]+ 287.12846 168.7
[M+K]+ 308.05780 160.7
[M+H-H2O]+ 252.09190 148.9
[M+HCOO]- 314.09284 171.2
[M+CH3COO]- 328.10849 197.1
[M+Na-2H]- 290.06931 161.9
[M]+ 269.09409 155.6
[M]- 269.09519 155.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.