CID 57777

Benzamide, p-amino-n-(3-(diethylamino)propyl)-n-(alpha-methylbenzyl)-, hydrochloride

Structural Information

Molecular Formula
C22H31N3O
SMILES
CCN(CC)CCCN(C(C)C1=CC=CC=C1)C(=O)C2=CC=C(C=C2)N
InChI
InChI=1S/C22H31N3O/c1-4-24(5-2)16-9-17-25(18(3)19-10-7-6-8-11-19)22(26)20-12-14-21(23)15-13-20/h6-8,10-15,18H,4-5,9,16-17,23H2,1-3H3
InChIKey
ASTFTLSNGNFVJB-UHFFFAOYSA-N
Compound name
4-amino-N-[3-(diethylamino)propyl]-N-(1-phenylethyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

353.2467 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 354.25398 192.2
[M+Na]+ 376.23592 193.6
[M-H]- 352.23942 199.7
[M+NH4]+ 371.28052 204.6
[M+K]+ 392.20986 191.4
[M+H-H2O]+ 336.24396 182.1
[M+HCOO]- 398.24490 215.6
[M+CH3COO]- 412.26055 230.4
[M+Na-2H]- 374.22137 191.3
[M]+ 353.24615 193.2
[M]- 353.24725 193.2
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.