CID 50989737

2-(3-aminopyrrolidin-1-yl)benzamide

Structural Information

Molecular Formula
C11H15N3O
SMILES
C1CN(CC1N)C2=CC=CC=C2C(=O)N
InChI
InChI=1S/C11H15N3O/c12-8-5-6-14(7-8)10-4-2-1-3-9(10)11(13)15/h1-4,8H,5-7,12H2,(H2,13,15)
InChIKey
LDZLPGWWCXDXFH-UHFFFAOYSA-N
Compound name
2-(3-aminopyrrolidin-1-yl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

205.1215 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.12878 145.5
[M+Na]+ 228.11072 151.3
[M-H]- 204.11422 149.9
[M+NH4]+ 223.15532 163.6
[M+K]+ 244.08466 148.3
[M+H-H2O]+ 188.11876 137.9
[M+HCOO]- 250.11970 167.7
[M+CH3COO]- 264.13535 189.2
[M+Na-2H]- 226.09617 146.9
[M]+ 205.12095 139.4
[M]- 205.12205 139.4
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