CID 9929

Dtxsid80963200

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]+ 292.169596 170.8
[M+Na]+ 314.151538 177.3
[M-H]- 290.155044 182.5
[M+NH4]+ 309.196143 186.8
[M+K]+ 330.125478 174.3
[M+H-H2O]+ 274.159580 162.1
[M+HCOO]- 336.160521 196.1
[M+CH3COO]- 350.176171 183.3
[M+Na-2H]- 312.136986 174.2
[M]+ 291.16177142 173.4
[M]- 291.16286858 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.