CID 79332934

1-(4-chlorophenyl)-2-ethylcyclopropan-1-amine

Structural Information

Molecular Formula
C11H14ClN
SMILES
CCC1CC1(C2=CC=C(C=C2)Cl)N
InChI
InChI=1S/C11H14ClN/c1-2-8-7-11(8,13)9-3-5-10(12)6-4-9/h3-6,8H,2,7,13H2,1H3
InChIKey
FCGRPVQZGCPWAA-UHFFFAOYSA-N
Compound name
1-(4-chlorophenyl)-2-ethylcyclopropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

195.08148 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.088756 136.9
[M+Na]+ 218.070698 147.6
[M-H]- 194.074204 144.3
[M+NH4]+ 213.115303 154.2
[M+K]+ 234.044638 143.2
[M+H-H2O]+ 178.078740 132.3
[M+HCOO]- 240.079681 157.1
[M+CH3COO]- 254.095331 188.7
[M+Na-2H]- 216.056146 143.3
[M]+ 195.08093142 140.0
[M]- 195.08202858 140.0
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.