CID 28890

Sa 48

Structural Information

Molecular Formula
C21H28N2O
SMILES
CC1=C(C(=CC=C1)C)N(C(C)CN(C)C)C(=O)CC2=CC=CC=C2
InChI
InChI=1S/C21H28N2O/c1-16-10-9-11-17(2)21(16)23(18(3)15-22(4)5)20(24)14-19-12-7-6-8-13-19/h6-13,18H,14-15H2,1-5H3
InChIKey
NMNDTUMXUMJCBG-UHFFFAOYSA-N
Compound name
N-[1-(dimethylamino)propan-2-yl]-N-(2,6-dimethylphenyl)-2-phenylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

63
Patents

324.22015 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.227426 182.7
[M+Na]+ 347.209368 186.3
[M-H]- 323.212874 191.4
[M+NH4]+ 342.253973 197.3
[M+K]+ 363.183308 184.6
[M+H-H2O]+ 307.217410 173.4
[M+HCOO]- 369.218351 206.0
[M+CH3COO]- 383.234001 224.2
[M+Na-2H]- 345.194816 182.3
[M]+ 324.21960142 185.5
[M]- 324.22069858 185.5
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