CID 2735310

N2-cyclopropylpyridine-2,3-diamine

Structural Information

Molecular Formula

C₈H₁₁N₃

SMILES

C1CC1NC2=C(C=CC=N2)N

InChI

InChI=1S/C8H11N3/c9-7-2-1-5-10-8(7)11-6-3-4-6/h1-2,5-6H,3-4,9H2,(H,10,11)

InChIKey

QHUFORDTLJHGBU-UHFFFAOYSA-N

Compound name

2-N-cyclopropylpyridine-2,3-diamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 14
Patents: 149.09529 Da
Monoisotopic Mass: 1.0
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]+	150.10257	130.8
[M+Na]+	172.08451	143.8
[M+NH4]+	167.12911	140.1
[M+K]+	188.05845	139.1
[M-H]-	148.08801	141.8
[M+Na-2H]-	170.06996	141.6
[M]+	149.09474	136.7
[M]-	149.09584	136.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe