CID 16228716

N-(3-aminophenyl)cyclopropanecarboxamide

Structural Information

Molecular Formula
C10H12N2O
SMILES
C1CC1C(=O)NC2=CC=CC(=C2)N
InChI
InChI=1S/C10H12N2O/c11-8-2-1-3-9(6-8)12-10(13)7-4-5-7/h1-3,6-7H,4-5,11H2,(H,12,13)
InChIKey
CAPDPGRIQUJAGR-UHFFFAOYSA-N
Compound name
N-(3-aminophenyl)cyclopropanecarboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

176.09496 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.10224 133.1
[M+Na]+ 199.08418 141.5
[M-H]- 175.08768 140.5
[M+NH4]+ 194.12878 147.8
[M+K]+ 215.05812 138.0
[M+H-H2O]+ 159.09222 126.6
[M+HCOO]- 221.09316 158.9
[M+CH3COO]- 235.10881 187.6
[M+Na-2H]- 197.06963 139.4
[M]+ 176.09441 132.8
[M]- 176.09551 132.8
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