CID 57799

N,n-diethyl-6-methoxy-3-phenyl-2-benzofuranmethylamine hydrochloride

Structural Information

Molecular Formula
C20H23NO2
SMILES
CCN(CC)CC1=C(C2=C(O1)C=C(C=C2)OC)C3=CC=CC=C3
InChI
InChI=1S/C20H23NO2/c1-4-21(5-2)14-19-20(15-9-7-6-8-10-15)17-12-11-16(22-3)13-18(17)23-19/h6-13H,4-5,14H2,1-3H3
InChIKey
FHZLVICLCVFBSM-UHFFFAOYSA-N
Compound name
N-ethyl-N-[(6-methoxy-3-phenyl-1-benzofuran-2-yl)methyl]ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

309.17288 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 310.18016 175.3
[M+Na]+ 332.16210 183.7
[M-H]- 308.16560 185.4
[M+NH4]+ 327.20670 192.3
[M+K]+ 348.13604 181.1
[M+H-H2O]+ 292.17014 167.3
[M+HCOO]- 354.17108 200.6
[M+CH3COO]- 368.18673 212.9
[M+Na-2H]- 330.14755 179.6
[M]+ 309.17233 182.6
[M]- 309.17343 182.6
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.