CID 28888

Sa 105

Structural Information

Molecular Formula
C23H32N2O
SMILES
CCN(CC)CCCN(C1=C(C=CC=C1C)C)C(=O)CC2=CC=CC=C2
InChI
InChI=1S/C23H32N2O/c1-5-24(6-2)16-11-17-25(23-19(3)12-10-13-20(23)4)22(26)18-21-14-8-7-9-15-21/h7-10,12-15H,5-6,11,16-18H2,1-4H3
InChIKey
STOJUOWCDNPDIQ-UHFFFAOYSA-N
Compound name
N-[3-(diethylamino)propyl]-N-(2,6-dimethylphenyl)-2-phenylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

284
Patents

352.25146 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 353.258736 192.2
[M+Na]+ 375.240678 195.2
[M-H]- 351.244184 200.3
[M+NH4]+ 370.285283 205.6
[M+K]+ 391.214618 192.4
[M+H-H2O]+ 335.248720 182.2
[M+HCOO]- 397.249661 215.8
[M+CH3COO]- 411.265311 229.2
[M+Na-2H]- 373.226126 191.8
[M]+ 352.25091142 196.2
[M]- 352.25200858 196.2
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

patents stripe