CID 210110

1-pyrrolidinecarboxamide, 3-anilino-

Structural Information

Molecular Formula
C11H15N3O
SMILES
C1CN(CC1NC2=CC=CC=C2)C(=O)N
InChI
InChI=1S/C11H15N3O/c12-11(15)14-7-6-10(8-14)13-9-4-2-1-3-5-9/h1-5,10,13H,6-8H2,(H2,12,15)
InChIKey
KHKRVTOBRQDCOU-UHFFFAOYSA-N
Compound name
3-anilinopyrrolidine-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

205.1215 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.128776 145.1
[M+Na]+ 228.110718 150.0
[M-H]- 204.114224 149.7
[M+NH4]+ 223.155323 163.2
[M+K]+ 244.084658 147.3
[M+H-H2O]+ 188.118760 137.1
[M+HCOO]- 250.119701 168.0
[M+CH3COO]- 264.135351 187.9
[M+Na-2H]- 226.096166 148.3
[M]+ 205.12095142 139.5
[M]- 205.12204858 139.5
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