CID 208656

32779-45-6

Structural Information

Molecular Formula
C21H25NO2
SMILES
CCN(CC)CCOC(C1=CC=CC=C1)C2=CC3=CC=CC=C3O2
InChI
InChI=1S/C21H25NO2/c1-3-22(4-2)14-15-23-21(17-10-6-5-7-11-17)20-16-18-12-8-9-13-19(18)24-20/h5-13,16,21H,3-4,14-15H2,1-2H3
InChIKey
ASCQFGNYZGITFG-UHFFFAOYSA-N
Compound name
2-[1-benzofuran-2-yl(phenyl)methoxy]-N,N-diethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

323.18854 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 324.195816 180.6
[M+Na]+ 346.177758 186.3
[M-H]- 322.181264 189.7
[M+NH4]+ 341.222363 196.2
[M+K]+ 362.151698 183.9
[M+H-H2O]+ 306.185800 172.0
[M+HCOO]- 368.186741 204.5
[M+CH3COO]- 382.202391 214.4
[M+Na-2H]- 344.163206 184.5
[M]+ 323.18799142 186.7
[M]- 323.18908858 186.7
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.