CID 3005816

907550-04-3

Structural Information

Molecular Formula
C4H7N5OS
SMILES
C1(=C(NC(=S)N1)NN)C(=O)N
InChI
InChI=1S/C4H7N5OS/c5-2(10)1-3(9-6)8-4(11)7-1/h9H,6H2,(H2,5,10)(H2,7,8,11)
InChIKey
QIVLFEHIERISEW-UHFFFAOYSA-N
Compound name
5-hydrazinyl-2-sulfanylidene-1,3-dihydroimidazole-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

173.03712 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.04440 132.3
[M+Na]+ 196.02634 140.6
[M-H]- 172.02984 130.7
[M+NH4]+ 191.07094 149.5
[M+K]+ 212.00028 135.8
[M+H-H2O]+ 156.03438 125.6
[M+HCOO]- 218.03532 149.4
[M+CH3COO]- 232.05097 178.3
[M+Na-2H]- 194.01179 133.3
[M]+ 173.03657 126.4
[M]- 173.03767 126.4
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.