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]+ 325.227426 182.0
[M+Na]+ 347.209368 186.3
[M-H]- 323.212874 189.5
[M+NH4]+ 342.253973 196.3
[M+K]+ 363.183308 183.2
[M+H-H2O]+ 307.217410 173.4
[M+HCOO]- 369.218351 204.3
[M+CH3COO]- 383.234001 219.7
[M+Na-2H]- 345.194816 184.4
[M]+ 324.21960142 183.6
[M]- 324.22069858 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