CID 209987

20809-16-9

Structural Information

Molecular Formula
C15H23NO2
SMILES
CCC(=O)C1=CC=C(C=C1)OCCN(CC)CC
InChI
InChI=1S/C15H23NO2/c1-4-15(17)13-7-9-14(10-8-13)18-12-11-16(5-2)6-3/h7-10H,4-6,11-12H2,1-3H3
InChIKey
YTVLBLIDZAJCAQ-UHFFFAOYSA-N
Compound name
1-[4-[2-(diethylamino)ethoxy]phenyl]propan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

249.17288 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.18016 161.0
[M+Na]+ 272.16210 166.0
[M-H]- 248.16560 165.3
[M+NH4]+ 267.20670 178.6
[M+K]+ 288.13604 164.9
[M+H-H2O]+ 232.17014 153.6
[M+HCOO]- 294.17108 184.7
[M+CH3COO]- 308.18673 202.9
[M+Na-2H]- 270.14755 163.5
[M]+ 249.17233 165.5
[M]- 249.17343 165.5
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