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-amino-4-pyridinyl)-pyrrolidin-1-ylmethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

191.10587 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.113146 141.9
[M+Na]+ 214.095088 148.2
[M-H]- 190.098594 145.2
[M+NH4]+ 209.139693 159.6
[M+K]+ 230.069028 145.6
[M+H-H2O]+ 174.103130 133.5
[M+HCOO]- 236.104071 162.7
[M+CH3COO]- 250.119721 182.6
[M+Na-2H]- 212.080536 145.0
[M]+ 191.10532142 137.2
[M]- 191.10641858 137.2
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