CID 24693537

N-(3-amino-4-methylphenyl)cyclopropanecarboxamide

Structural Information

Molecular Formula
C11H14N2O
SMILES
CC1=C(C=C(C=C1)NC(=O)C2CC2)N
InChI
InChI=1S/C11H14N2O/c1-7-2-5-9(6-10(7)12)13-11(14)8-3-4-8/h2,5-6,8H,3-4,12H2,1H3,(H,13,14)
InChIKey
FUCQTJFDLUJCRG-UHFFFAOYSA-N
Compound name
N-(3-amino-4-methylphenyl)cyclopropanecarboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

29
Patents

190.11061 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.117886 137.5
[M+Na]+ 213.099828 146.2
[M-H]- 189.103334 145.0
[M+NH4]+ 208.144433 151.9
[M+K]+ 229.073768 142.5
[M+H-H2O]+ 173.107870 131.0
[M+HCOO]- 235.108811 162.8
[M+CH3COO]- 249.124461 191.6
[M+Na-2H]- 211.085276 142.5
[M]+ 190.11006142 137.8
[M]- 190.11115858 137.8
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