CID 25219133

1060817-34-6

Structural Information

Molecular Formula

C₁₀H₁₃N₃O

SMILES

C1CCN(C1)C(=O)C2=CC(=NC=C2)N

InChI

InChI=1S/C10H13N3O/c11-9-7-8(3-4-12-9)10(14)13-5-1-2-6-13/h3-4,7H,1-2,5-6H2,(H2,11,12)

InChIKey

REBIXQGJYXBIRH-UHFFFAOYSA-N

Compound name

(2-aminopyridin-4-yl)-pyrrolidin-1-ylmethanone

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 28
Patents: 191.10587 Da
Monoisotopic Mass: 0.5
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]+	192.11315	142.5
[M+Na]+	214.09509	152.9
[M+NH4]+	209.13969	150.0
[M+K]+	230.06903	149.4
[M-H]-	190.09859	144.8
[M+Na-2H]-	212.08054	148.7
[M]+	191.10532	144.2
[M]-	191.10642	144.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe