CID 79496527

2243507-29-9

Structural Information

Molecular Formula

C₅H₁₃N₃

SMILES

C(CCN)CC(=N)N

InChI

InChI=1S/C5H13N3/c6-4-2-1-3-5(7)8/h1-4,6H2,(H3,7,8)

InChIKey

MOATUNIZJAXRFH-UHFFFAOYSA-N

Compound name

5-aminopentanimidamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 6
Patents: 115.11095 Da
Monoisotopic Mass: -1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	116.118226	125.6
[M+Na]+	138.100168	130.7
[M-H]-	114.103674	124.9
[M+NH4]+	133.144773	146.6
[M+K]+	154.074108	129.7
[M+H-H2O]+	98.108210	120.0
[M+HCOO]-	160.109151	150.5
[M+CH3COO]-	174.124801	177.5
[M+Na-2H]-	136.085616	130.2
[M]+	115.11040142	120.5
[M]-	115.11149858	120.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe