CID 59896

Benzamide, n-(2-(diethylamino)ethyl)-4-((2,2-dimethyl-1-oxopropyl)amino)-, ethanedioate (1:1)

Structural Information

Molecular Formula
C18H29N3O2
SMILES
CCN(CC)CCNC(=O)C1=CC=C(C=C1)NC(=O)C(C)(C)C
InChI
InChI=1S/C18H29N3O2/c1-6-21(7-2)13-12-19-16(22)14-8-10-15(11-9-14)20-17(23)18(3,4)5/h8-11H,6-7,12-13H2,1-5H3,(H,19,22)(H,20,23)
InChIKey
FPMXNEDVPDADNA-UHFFFAOYSA-N
Compound name
N-[2-(diethylamino)ethyl]-4-(2,2-dimethylpropanoylamino)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

319.22598 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 320.233256 181.5
[M+Na]+ 342.215198 184.0
[M-H]- 318.218704 185.6
[M+NH4]+ 337.259803 195.6
[M+K]+ 358.189138 182.9
[M+H-H2O]+ 302.223240 173.5
[M+HCOO]- 364.224181 203.9
[M+CH3COO]- 378.239831 220.4
[M+Na-2H]- 340.200646 182.7
[M]+ 319.22543142 183.4
[M]- 319.22652858 183.4
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.