CID 3042559

R 735

Structural Information

Molecular Formula
C21H28N2O
SMILES
CCCN(CCC)CC(=O)NC(C1=CC=CC=C1)C2=CC=CC=C2
InChI
InChI=1S/C21H28N2O/c1-3-15-23(16-4-2)17-20(24)22-21(18-11-7-5-8-12-18)19-13-9-6-10-14-19/h5-14,21H,3-4,15-17H2,1-2H3,(H,22,24)
InChIKey
BFALUTVKCIWKHY-UHFFFAOYSA-N
Compound name
N-benzhydryl-2-(dipropylamino)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

324.22015 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.227426 183.2
[M+Na]+ 347.209368 184.7
[M-H]- 323.212874 189.5
[M+NH4]+ 342.253973 196.4
[M+K]+ 363.183308 181.4
[M+H-H2O]+ 307.217410 173.5
[M+HCOO]- 369.218351 206.0
[M+CH3COO]- 383.234001 218.4
[M+Na-2H]- 345.194816 184.9
[M]+ 324.21960142 183.8
[M]- 324.22069858 183.8
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.