CID 218211

Pseudourea, 2,2'-(oxydimethylene)bis(2-thio-, dihydrochloride

Structural Information

Molecular Formula
C4H10N4OS2
SMILES
C(OCSC(=N)N)SC(=N)N
InChI
InChI=1S/C4H10N4OS2/c5-3(6)10-1-9-2-11-4(7)8/h1-2H2,(H3,5,6)(H3,7,8)
InChIKey
GIIICNPLJCTEHW-UHFFFAOYSA-N
Compound name
carbamimidoylsulfanylmethoxymethyl carbamimidothioate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.0296 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.03688 136.4
[M+Na]+ 217.01882 140.4
[M-H]- 193.02232 134.7
[M+NH4]+ 212.06342 153.7
[M+K]+ 232.99276 136.3
[M+H-H2O]+ 177.02686 129.1
[M+HCOO]- 239.02780 149.5
[M+CH3COO]- 253.04345 189.1
[M+Na-2H]- 215.00427 136.4
[M]+ 194.02905 132.5
[M]- 194.03015 132.5
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.