CID 16795831

N-[1-(2-chlorophenyl)ethyl]cyclopropanamine

Structural Information

Molecular Formula
C11H14ClN
SMILES
CC(C1=CC=CC=C1Cl)NC2CC2
InChI
InChI=1S/C11H14ClN/c1-8(13-9-6-7-9)10-4-2-3-5-11(10)12/h2-5,8-9,13H,6-7H2,1H3
InChIKey
LLWLXYGPGGEOBT-UHFFFAOYSA-N
Compound name
N-[1-(2-chlorophenyl)ethyl]cyclopropanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

195.08148 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.08876 136.6
[M+Na]+ 218.07070 145.4
[M-H]- 194.07420 143.8
[M+NH4]+ 213.11530 151.8
[M+K]+ 234.04464 140.9
[M+H-H2O]+ 178.07874 130.7
[M+HCOO]- 240.07968 156.8
[M+CH3COO]- 254.09533 189.5
[M+Na-2H]- 216.05615 142.5
[M]+ 195.08093 139.3
[M]- 195.08203 139.3
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