CID 58608

101651-55-2

Structural Information

Molecular Formula
C21H29N3O
SMILES
CCN(CC)CCN(CC1=CC=CC=C1)CC(=O)NC2=CC=CC=C2
InChI
InChI=1S/C21H29N3O/c1-3-23(4-2)15-16-24(17-19-11-7-5-8-12-19)18-21(25)22-20-13-9-6-10-14-20/h5-14H,3-4,15-18H2,1-2H3,(H,22,25)
InChIKey
LYUWSJKZHVGZLJ-UHFFFAOYSA-N
Compound name
2-[benzyl-[2-(diethylamino)ethyl]amino]-N-phenylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

339.23105 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 340.238326 186.5
[M+Na]+ 362.220268 187.5
[M-H]- 338.223774 194.1
[M+NH4]+ 357.264873 199.4
[M+K]+ 378.194208 185.3
[M+H-H2O]+ 322.228310 176.0
[M+HCOO]- 384.229251 211.8
[M+CH3COO]- 398.244901 225.9
[M+Na-2H]- 360.205716 189.1
[M]+ 339.23050142 188.3
[M]- 339.23159858 188.3
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.