CID 53860

Brn 5078847

Structural Information

Molecular Formula
C11H19N5OS
SMILES
CCN(CC)C1=NC(=NC(=C1)C)SCC(=O)NN
InChI
InChI=1S/C11H19N5OS/c1-4-16(5-2)9-6-8(3)13-11(14-9)18-7-10(17)15-12/h6H,4-5,7,12H2,1-3H3,(H,15,17)
InChIKey
ZHZZBTFMZIKEGT-UHFFFAOYSA-N
Compound name
2-[4-(diethylamino)-6-methylpyrimidin-2-yl]sulfanylacetohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

269.13104 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.13832 161.8
[M+Na]+ 292.12026 167.8
[M-H]- 268.12376 163.6
[M+NH4]+ 287.16486 175.8
[M+K]+ 308.09420 165.0
[M+H-H2O]+ 252.12830 152.9
[M+HCOO]- 314.12924 179.8
[M+CH3COO]- 328.14489 207.8
[M+Na-2H]- 290.10571 163.1
[M]+ 269.13049 164.2
[M]- 269.13159 164.2
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.