CID 293442

2-(2,3-dimethylphenoxy)ethyldiethylamine

Structural Information

Molecular Formula
C14H23NO
SMILES
CCN(CC)CCOC1=CC=CC(=C1C)C
InChI
InChI=1S/C14H23NO/c1-5-15(6-2)10-11-16-14-9-7-8-12(3)13(14)4/h7-9H,5-6,10-11H2,1-4H3
InChIKey
BKRYKHHLQNEVRM-UHFFFAOYSA-N
Compound name
2-(2,3-dimethylphenoxy)-N,N-diethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

221.17796 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.18524 153.6
[M+Na]+ 244.16718 160.0
[M-H]- 220.17068 158.4
[M+NH4]+ 239.21178 172.9
[M+K]+ 260.14112 158.8
[M+H-H2O]+ 204.17522 146.8
[M+HCOO]- 266.17616 178.2
[M+CH3COO]- 280.19181 199.1
[M+Na-2H]- 242.15263 157.2
[M]+ 221.17741 158.0
[M]- 221.17851 158.0
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.