CID 78712

Bromodiethylaminoethoxybenzanilide

Structural Information

Molecular Formula
C19H23BrN2O2
SMILES
CCN(CC)CCOC1=C(C=C(C=C1)Br)C(=O)NC2=CC=CC=C2
InChI
InChI=1S/C19H23BrN2O2/c1-3-22(4-2)12-13-24-18-11-10-15(20)14-17(18)19(23)21-16-8-6-5-7-9-16/h5-11,14H,3-4,12-13H2,1-2H3,(H,21,23)
InChIKey
LPDBFJGKSBYQRE-UHFFFAOYSA-N
Compound name
5-bromo-2-[2-(diethylamino)ethoxy]-N-phenylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

390.0943 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 391.10158 186.4
[M+Na]+ 413.08352 193.3
[M-H]- 389.08702 195.6
[M+NH4]+ 408.12812 201.2
[M+K]+ 429.05746 181.9
[M+H-H2O]+ 373.09156 182.5
[M+HCOO]- 435.09250 208.1
[M+CH3COO]- 449.10815 223.5
[M+Na-2H]- 411.06897 189.6
[M]+ 390.09375 207.2
[M]- 390.09485 207.2
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