CID 773445

4-tert-butyl-n-[4-(diethylamino)phenyl]benzamide

Structural Information

Molecular Formula
C21H28N2O
SMILES
CCN(CC)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)C(C)(C)C
InChI
InChI=1S/C21H28N2O/c1-6-23(7-2)19-14-12-18(13-15-19)22-20(24)16-8-10-17(11-9-16)21(3,4)5/h8-15H,6-7H2,1-5H3,(H,22,24)
InChIKey
HYGIXGPPMXYTSS-UHFFFAOYSA-N
Compound name
4-tert-butyl-N-[4-(diethylamino)phenyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

324.22015 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.22743 182.0
[M+Na]+ 347.20937 186.3
[M-H]- 323.21287 189.5
[M+NH4]+ 342.25397 196.3
[M+K]+ 363.18331 183.2
[M+H-H2O]+ 307.21741 173.4
[M+HCOO]- 369.21835 204.3
[M+CH3COO]- 383.23400 219.7
[M+Na-2H]- 345.19482 184.4
[M]+ 324.21960 183.6
[M]- 324.22070 183.6
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