CID 49608

Brn 2643210

Structural Information

Molecular Formula
C11H24N4
SMILES
CN(CCN=C(N)N)C1CCCCCC1
InChI
InChI=1S/C11H24N4/c1-15(9-8-14-11(12)13)10-6-4-2-3-5-7-10/h10H,2-9H2,1H3,(H4,12,13,14)
InChIKey
BEKGDTDKGGSAPE-UHFFFAOYSA-N
Compound name
2-[2-[cycloheptyl(methyl)amino]ethyl]guanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

212.2001 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.20738 149.0
[M+Na]+ 235.18932 148.2
[M-H]- 211.19282 154.0
[M+NH4]+ 230.23392 165.5
[M+K]+ 251.16326 153.4
[M+H-H2O]+ 195.19736 140.9
[M+HCOO]- 257.19830 171.6
[M+CH3COO]- 271.21395 203.0
[M+Na-2H]- 233.17477 150.6
[M]+ 212.19955 139.3
[M]- 212.20065 139.3
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.