CID 423935

1-dibenzofuran-2-yl-3-(diethylamino)propan-1-one

Structural Information

Molecular Formula
C19H21NO2
SMILES
CCN(CC)CCC(=O)C1=CC2=C(C=C1)OC3=CC=CC=C32
InChI
InChI=1S/C19H21NO2/c1-3-20(4-2)12-11-17(21)14-9-10-19-16(13-14)15-7-5-6-8-18(15)22-19/h5-10,13H,3-4,11-12H2,1-2H3
InChIKey
UZBZGIXCPDHPBI-UHFFFAOYSA-N
Compound name
1-dibenzofuran-2-yl-3-(diethylamino)propan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

295.15723 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.16451 171.4
[M+Na]+ 318.14645 179.2
[M-H]- 294.14995 178.9
[M+NH4]+ 313.19105 189.8
[M+K]+ 334.12039 176.6
[M+H-H2O]+ 278.15449 164.2
[M+HCOO]- 340.15543 194.6
[M+CH3COO]- 354.17108 210.7
[M+Na-2H]- 316.13190 176.4
[M]+ 295.15668 177.9
[M]- 295.15778 177.9
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.