CID 118897

N,n-diethyl-2,5-diethoxyaniline

Structural Information

Molecular Formula
C14H23NO2
SMILES
CCN(CC)C1=C(C=CC(=C1)OCC)OCC
InChI
InChI=1S/C14H23NO2/c1-5-15(6-2)13-11-12(16-7-3)9-10-14(13)17-8-4/h9-11H,5-8H2,1-4H3
InChIKey
XXJMDOIBGIZHNR-UHFFFAOYSA-N
Compound name
2,5-diethoxy-N,N-diethylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

237.17288 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.18016 156.8
[M+Na]+ 260.16210 163.2
[M-H]- 236.16560 161.6
[M+NH4]+ 255.20670 175.5
[M+K]+ 276.13604 162.5
[M+H-H2O]+ 220.17014 149.8
[M+HCOO]- 282.17108 181.7
[M+CH3COO]- 296.18673 201.1
[M+Na-2H]- 258.14755 160.5
[M]+ 237.17233 162.7
[M]- 237.17343 162.7
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