CID 16227158

N-[4-(aminomethyl)phenyl]cyclopropanecarboxamide

Structural Information

Molecular Formula
C11H14N2O
SMILES
C1CC1C(=O)NC2=CC=C(C=C2)CN
InChI
InChI=1S/C11H14N2O/c12-7-8-1-5-10(6-2-8)13-11(14)9-3-4-9/h1-2,5-6,9H,3-4,7,12H2,(H,13,14)
InChIKey
NZFQLRBYHZMULN-UHFFFAOYSA-N
Compound name
N-[4-(aminomethyl)phenyl]cyclopropanecarboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

190.11061 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.117886 137.3
[M+Na]+ 213.099828 145.2
[M-H]- 189.103334 144.5
[M+NH4]+ 208.144433 151.4
[M+K]+ 229.073768 141.6
[M+H-H2O]+ 173.107870 130.6
[M+HCOO]- 235.108811 162.8
[M+CH3COO]- 249.124461 190.5
[M+Na-2H]- 211.085276 143.1
[M]+ 190.11006142 137.3
[M]- 190.11115858 137.3
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