CID 695704

N-(2-cyanophenyl)cyclopropanecarboxamide

Structural Information

Molecular Formula
C11H10N2O
SMILES
C1CC1C(=O)NC2=CC=CC=C2C#N
InChI
InChI=1S/C11H10N2O/c12-7-9-3-1-2-4-10(9)13-11(14)8-5-6-8/h1-4,8H,5-6H2,(H,13,14)
InChIKey
GFEUMLAOXFFPOS-UHFFFAOYSA-N
Compound name
N-(2-cyanophenyl)cyclopropanecarboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

186.07932 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.086596 138.4
[M+Na]+ 209.068538 153.1
[M-H]- 185.072044 146.8
[M+NH4]+ 204.113143 153.3
[M+K]+ 225.042478 146.2
[M+H-H2O]+ 169.076580 128.2
[M+HCOO]- 231.077521 161.3
[M+CH3COO]- 245.093171 198.9
[M+Na-2H]- 207.053986 145.6
[M]+ 186.07877142 136.5
[M]- 186.07986858 136.5
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.