CID 53942

C 5354

Structural Information

Molecular Formula
C24H35N3O
SMILES
CCN(CC)CCCN(CC1=CC=CC=C1)CC(=O)NC2=C(C=CC=C2C)C
InChI
InChI=1S/C24H35N3O/c1-5-26(6-2)16-11-17-27(18-22-14-8-7-9-15-22)19-23(28)25-24-20(3)12-10-13-21(24)4/h7-10,12-15H,5-6,11,16-19H2,1-4H3,(H,25,28)
InChIKey
KRVVODSVEMUIOT-UHFFFAOYSA-N
Compound name
2-[benzyl-[3-(diethylamino)propyl]amino]-N-(2,6-dimethylphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

381.278 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 382.28528 200.6
[M+Na]+ 404.26722 202.2
[M-H]- 380.27072 208.4
[M+NH4]+ 399.31182 212.4
[M+K]+ 420.24116 199.4
[M+H-H2O]+ 364.27526 190.0
[M+HCOO]- 426.27620 224.8
[M+CH3COO]- 440.29185 237.2
[M+Na-2H]- 402.25267 200.1
[M]+ 381.27745 204.2
[M]- 381.27855 204.2
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.