CID 57345804

32289-58-0

Structural Information

Molecular Formula
C10H23N5
SMILES
CC(=NCCCCCCNC(=NC)N)N
InChI
InChI=1S/C10H23N5/c1-9(11)14-7-5-3-4-6-8-15-10(12)13-2/h3-8H2,1-2H3,(H2,11,14)(H3,12,13,15)
InChIKey
SAGIGHPRUJPLKX-UHFFFAOYSA-N
Compound name
N'-[6-[(N'-methylcarbamimidoyl)amino]hexyl]ethanimidamide
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

0
References

49
Patents

213.19534 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.20262 153.6
[M+Na]+ 236.18456 156.1
[M-H]- 212.18806 155.0
[M+NH4]+ 231.22916 171.5
[M+K]+ 252.15850 155.9
[M+H-H2O]+ 196.19260 145.7
[M+HCOO]- 258.19354 181.2
[M+CH3COO]- 272.20919 206.1
[M+Na-2H]- 234.17001 156.0
[M]+ 213.19479 151.1
[M]- 213.19589 151.1
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

patents stripe