CID 9929

3-furanethanamine, n,n-dimethyl-2,5-diphenyl-, hydrochloride

Structural Information

Molecular Formula
C20H21NO
SMILES
CN(C)CCC1=C(OC(=C1)C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C20H21NO/c1-21(2)14-13-18-15-19(16-9-5-3-6-10-16)22-20(18)17-11-7-4-8-12-17/h3-12,15H,13-14H2,1-2H3
InChIKey
SLLFDPJHLZEFRI-UHFFFAOYSA-N
Compound name
2-(2,5-diphenylfuran-3-yl)-N,N-dimethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

291.16232 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.16960 170.8
[M+Na]+ 314.15154 177.3
[M-H]- 290.15504 182.5
[M+NH4]+ 309.19614 186.8
[M+K]+ 330.12548 174.3
[M+H-H2O]+ 274.15958 162.1
[M+HCOO]- 336.16052 196.1
[M+CH3COO]- 350.17617 183.3
[M+Na-2H]- 312.13699 174.2
[M]+ 291.16177 173.4
[M]- 291.16287 173.4
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.