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]+ 388.227096 198.8
[M+Na]+ 410.209038 200.8
[M-H]- 386.212544 208.0
[M+NH4]+ 405.253643 209.1
[M+K]+ 426.182978 196.6
[M+H-H2O]+ 370.217080 187.6
[M+HCOO]- 432.218021 220.1
[M+CH3COO]- 446.233671 227.8
[M+Na-2H]- 408.194486 199.2
[M]+ 387.21927142 200.7
[M]- 387.22036858 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

patents stripe