CID 71315618

Bsa6hft7wb

Structural Information

Molecular Formula
C26H29NO2
SMILES
CCN(CC)CCOC1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)C3=CC=CC=C3
InChI
InChI=1S/C26H29NO2/c1-3-27(4-2)19-20-29-24-17-15-22(16-18-24)25(21-11-7-5-8-12-21)26(28)23-13-9-6-10-14-23/h5-18,25H,3-4,19-20H2,1-2H3
InChIKey
QRDUUUZNVAYWOU-UHFFFAOYSA-N
Compound name
2-[4-[2-(diethylamino)ethoxy]phenyl]-1,2-diphenylethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

387.21982 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 388.22710 198.8
[M+Na]+ 410.20904 200.8
[M-H]- 386.21254 208.0
[M+NH4]+ 405.25364 209.1
[M+K]+ 426.18298 196.6
[M+H-H2O]+ 370.21708 187.6
[M+HCOO]- 432.21802 220.1
[M+CH3COO]- 446.23367 227.8
[M+Na-2H]- 408.19449 199.2
[M]+ 387.21927 200.7
[M]- 387.22037 200.7
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.