CID 58165

P-amino-n-benzyl-n-(3-(diethylamino)propyl)benzamide hydrochloride

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

339.23105 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 340.238326 187.2
[M+Na]+ 362.220268 189.2
[M-H]- 338.223774 194.7
[M+NH4]+ 357.264873 200.2
[M+K]+ 378.194208 186.7
[M+H-H2O]+ 322.228310 177.0
[M+HCOO]- 384.229251 211.9
[M+CH3COO]- 398.244901 226.5
[M+Na-2H]- 360.205716 188.0
[M]+ 339.23050142 188.4
[M]- 339.23159858 188.4
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.