CID 3035116

4-hydrazino-2-thiouracil

Structural Information

Molecular Formula
C4H6N4OS
SMILES
C1C(=O)NC(=S)N=C1NN
InChI
InChI=1S/C4H6N4OS/c5-8-2-1-3(9)7-4(10)6-2/h1,5H2,(H2,6,7,8,9,10)
InChIKey
STJUCHMWALAVJS-UHFFFAOYSA-N
Compound name
6-hydrazinyl-2-sulfanylidene-5H-pyrimidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

158.02623 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.03351 129.9
[M+Na]+ 181.01545 137.9
[M-H]- 157.01895 129.3
[M+NH4]+ 176.06005 147.2
[M+K]+ 196.98939 133.9
[M+H-H2O]+ 141.02349 123.3
[M+HCOO]- 203.02443 145.6
[M+CH3COO]- 217.04008 174.8
[M+Na-2H]- 179.00090 133.2
[M]+ 158.02568 124.6
[M]- 158.02678 124.6
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.