CID 24838038

Ethanone, 1,1'-(6-(2-(diethylamino)ethoxy)-2,5-benzofurandiyl)bis-, hydrochloride

Structural Information

Molecular Formula
C18H23NO4
SMILES
CCN(CC)CCOC1=C(C=C2C=C(OC2=C1)C(=O)C)C(=O)C
InChI
InChI=1S/C18H23NO4/c1-5-19(6-2)7-8-22-18-11-17-14(9-15(18)12(3)20)10-16(23-17)13(4)21/h9-11H,5-8H2,1-4H3
InChIKey
GMHWLDYFIWQILT-UHFFFAOYSA-N
Compound name
1-[5-acetyl-6-[2-(diethylamino)ethoxy]-1-benzofuran-2-yl]ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

317.16272 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 318.169996 176.6
[M+Na]+ 340.151938 184.1
[M-H]- 316.155444 183.4
[M+NH4]+ 335.196543 193.2
[M+K]+ 356.125878 183.6
[M+H-H2O]+ 300.159980 169.7
[M+HCOO]- 362.160921 199.9
[M+CH3COO]- 376.176571 215.6
[M+Na-2H]- 338.137386 177.7
[M]+ 317.16217142 186.0
[M]- 317.16326858 186.0
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.