CID 208657

32779-46-7

Structural Information

Molecular Formula
C21H24ClNO2
SMILES
CCN(CC)CCOC(C1=CC=C(C=C1)Cl)C2=CC3=CC=CC=C3O2
InChI
InChI=1S/C21H24ClNO2/c1-3-23(4-2)13-14-24-21(16-9-11-18(22)12-10-16)20-15-17-7-5-6-8-19(17)25-20/h5-12,15,21H,3-4,13-14H2,1-2H3
InChIKey
JQQRZLQNEFPTBZ-UHFFFAOYSA-N
Compound name
2-[1-benzofuran-2-yl-(4-chlorophenyl)methoxy]-N,N-diethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

357.14957 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 358.15685 185.8
[M+Na]+ 380.13879 200.8
[M+NH4]+ 375.18339 194.9
[M+K]+ 396.11273 193.3
[M-H]- 356.14229 192.9
[M+Na-2H]- 378.12424 193.7
[M]+ 357.14902 190.5
[M]- 357.15012 190.5
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

No patent data available for this compound.