CID 53403099

2247101-93-3

Structural Information

Molecular Formula

C₇H₁₁N₃

SMILES

C1CC1CN2C=C(N=C2)N

InChI

InChI=1S/C7H11N3/c8-7-4-10(5-9-7)3-6-1-2-6/h4-6H,1-3,8H2

InChIKey

PSTRGTVJXATEJU-UHFFFAOYSA-N

Compound name

1-(cyclopropylmethyl)imidazol-4-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 137.09529 Da
Monoisotopic Mass: 0.3
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]+	138.10257	129.5
[M+Na]+	160.08451	141.9
[M+NH4]+	155.12911	138.4
[M+K]+	176.05845	139.3
[M-H]-	136.08801	138.6
[M+Na-2H]-	158.06996	138.6
[M]+	137.09474	134.7
[M]-	137.09584	134.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe