CID 200938

2948-77-8

Structural Information

Molecular Formula
C10H22N4
SMILES
CC1CCCN(CC1)CCN=C(N)N
InChI
InChI=1S/C10H22N4/c1-9-3-2-6-14(7-4-9)8-5-13-10(11)12/h9H,2-8H2,1H3,(H4,11,12,13)
InChIKey
KDIMDNGDUIGURW-UHFFFAOYSA-N
Compound name
2-[2-(4-methylazepan-1-yl)ethyl]guanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

198.18445 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.19173 145.1
[M+Na]+ 221.17367 146.4
[M-H]- 197.17717 147.9
[M+NH4]+ 216.21827 161.0
[M+K]+ 237.14761 150.1
[M+H-H2O]+ 181.18171 136.6
[M+HCOO]- 243.18265 165.4
[M+CH3COO]- 257.19830 195.7
[M+Na-2H]- 219.15912 147.1
[M]+ 198.18390 135.4
[M]- 198.18500 135.4
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.