CID 204339

Guanidine, n,n'''-(dithiodi-2,1-ethanediyl)bis(n-methyl-, dihydrobromide

Structural Information

Molecular Formula
C8H20N6S2
SMILES
CN(CCSSCCN(C)C(=N)N)C(=N)N
InChI
InChI=1S/C8H20N6S2/c1-13(7(9)10)3-5-15-16-6-4-14(2)8(11)12/h3-6H2,1-2H3,(H3,9,10)(H3,11,12)
InChIKey
WBPROHVWDKNDSR-UHFFFAOYSA-N
Compound name
1-[2-[2-[carbamimidoyl(methyl)amino]ethyldisulfanyl]ethyl]-1-methylguanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

264.11908 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.12636 157.2
[M+Na]+ 287.10830 158.2
[M-H]- 263.11180 157.4
[M+NH4]+ 282.15290 172.2
[M+K]+ 303.08224 155.6
[M+H-H2O]+ 247.11634 147.7
[M+HCOO]- 309.11728 171.2
[M+CH3COO]- 323.13293 215.6
[M+Na-2H]- 285.09375 155.4
[M]+ 264.11853 154.1
[M]- 264.11963 154.1
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.