CID 24692745

3-[(cyclopropylamino)methyl]benzamide

Structural Information

Molecular Formula
C11H14N2O
SMILES
C1CC1NCC2=CC(=CC=C2)C(=O)N
InChI
InChI=1S/C11H14N2O/c12-11(14)9-3-1-2-8(6-9)7-13-10-4-5-10/h1-3,6,10,13H,4-5,7H2,(H2,12,14)
InChIKey
UHOFEWXXDYXBPL-UHFFFAOYSA-N
Compound name
3-[(cyclopropylamino)methyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

190.11061 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.11789 141.9
[M+Na]+ 213.09983 153.8
[M+NH4]+ 208.14443 150.6
[M+K]+ 229.07377 149.4
[M-H]- 189.10333 152.7
[M+Na-2H]- 211.08528 151.5
[M]+ 190.11006 147.5
[M]- 190.11116 147.5
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

No patent data available for this compound.