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]+ 320.23326 181.5
[M+Na]+ 342.21520 184.0
[M-H]- 318.21870 185.6
[M+NH4]+ 337.25980 195.6
[M+K]+ 358.18914 182.9
[M+H-H2O]+ 302.22324 173.5
[M+HCOO]- 364.22418 203.9
[M+CH3COO]- 378.23983 220.4
[M+Na-2H]- 340.20065 182.7
[M]+ 319.22543 183.4
[M]- 319.22653 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.