CID 26494

1-(2-(4-methylpiperidino)ethyl)guanidine sulfate hemihydrate

Structural Information

Molecular Formula
C9H20N4
SMILES
CC1CCN(CC1)CCN=C(N)N
InChI
InChI=1S/C9H20N4/c1-8-2-5-13(6-3-8)7-4-12-9(10)11/h8H,2-7H2,1H3,(H4,10,11,12)
InChIKey
GFMKQYJZRJKDNJ-UHFFFAOYSA-N
Compound name
2-[2-(4-methylpiperidin-1-yl)ethyl]guanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

3
Patents

184.1688 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.17608 144.3
[M+Na]+ 207.15802 147.6
[M-H]- 183.16152 145.9
[M+NH4]+ 202.20262 161.9
[M+K]+ 223.13196 146.3
[M+H-H2O]+ 167.16606 136.6
[M+HCOO]- 229.16700 165.7
[M+CH3COO]- 243.18265 191.7
[M+Na-2H]- 205.14347 146.9
[M]+ 184.16825 137.0
[M]- 184.16935 137.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe