CID 45223

2-(2-(diethylamino)-1-oxoethyl)dibenzofuran hydrochloride

Structural Information

Molecular Formula
C18H19NO2
SMILES
CCN(CC)CC(=O)C1=CC2=C(C=C1)OC3=CC=CC=C32
InChI
InChI=1S/C18H19NO2/c1-3-19(4-2)12-16(20)13-9-10-18-15(11-13)14-7-5-6-8-17(14)21-18/h5-11H,3-4,12H2,1-2H3
InChIKey
GRTGSFMDEVNVKI-UHFFFAOYSA-N
Compound name
1-dibenzofuran-2-yl-2-(diethylamino)ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

281.14157 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.14885 166.5
[M+Na]+ 304.13079 174.8
[M-H]- 280.13429 174.2
[M+NH4]+ 299.17539 185.5
[M+K]+ 320.10473 172.4
[M+H-H2O]+ 264.13883 159.5
[M+HCOO]- 326.13977 190.0
[M+CH3COO]- 340.15542 207.8
[M+Na-2H]- 302.11624 172.1
[M]+ 281.14102 172.7
[M]- 281.14212 172.7
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

No patent data available for this compound.