CID 56854

1-(2-(isobutylisopropylamino)ethyl)guanidine sulfate hydrate

Structural Information

Molecular Formula
C10H24N4
SMILES
CC(C)CN(CCN=C(N)N)C(C)C
InChI
InChI=1S/C10H24N4/c1-8(2)7-14(9(3)4)6-5-13-10(11)12/h8-9H,5-7H2,1-4H3,(H4,11,12,13)
InChIKey
JFSOHBAFGGSTPE-UHFFFAOYSA-N
Compound name
2-[2-[2-methylpropyl(propan-2-yl)amino]ethyl]guanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

200.2001 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.20738 154.4
[M+Na]+ 223.18932 156.8
[M-H]- 199.19282 155.9
[M+NH4]+ 218.23392 173.0
[M+K]+ 239.16326 158.1
[M+H-H2O]+ 183.19736 147.1
[M+HCOO]- 245.19830 178.7
[M+CH3COO]- 259.21395 204.9
[M+Na-2H]- 221.17477 153.7
[M]+ 200.19955 152.2
[M]- 200.20065 152.2
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.