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]+ 340.23833 186.5
[M+Na]+ 362.22027 187.5
[M-H]- 338.22377 194.1
[M+NH4]+ 357.26487 199.4
[M+K]+ 378.19421 185.3
[M+H-H2O]+ 322.22831 176.0
[M+HCOO]- 384.22925 211.8
[M+CH3COO]- 398.24490 225.9
[M+Na-2H]- 360.20572 189.1
[M]+ 339.23050 188.3
[M]- 339.23160 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.