CID 18449144

N-[2-(2-amino-4-chlorophenoxy)ethyl]-n,n-dimethylamine

Structural Information

Molecular Formula
C10H15ClN2O
SMILES
CN(C)CCOC1=C(C=C(C=C1)Cl)N
InChI
InChI=1S/C10H15ClN2O/c1-13(2)5-6-14-10-4-3-8(11)7-9(10)12/h3-4,7H,5-6,12H2,1-2H3
InChIKey
OQTYBJCISJYPPM-UHFFFAOYSA-N
Compound name
5-chloro-2-[2-(dimethylamino)ethoxy]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

15
Patents

214.0873 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.09458 146.9
[M+Na]+ 237.07652 155.0
[M-H]- 213.08002 151.6
[M+NH4]+ 232.12112 166.8
[M+K]+ 253.05046 152.3
[M+H-H2O]+ 197.08456 141.3
[M+HCOO]- 259.08550 168.8
[M+CH3COO]- 273.10115 195.0
[M+Na-2H]- 235.06197 151.3
[M]+ 214.08675 150.2
[M]- 214.08785 150.2
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