CID 184524

105668-70-0

Structural Information

Molecular Formula
C19H33N3O
SMILES
CC1=C(C(=CC=C1)C)NC(=O)CCNCCN(C(C)C)C(C)C
InChI
InChI=1S/C19H33N3O/c1-14(2)22(15(3)4)13-12-20-11-10-18(23)21-19-16(5)8-7-9-17(19)6/h7-9,14-15,20H,10-13H2,1-6H3,(H,21,23)
InChIKey
XGONVQVTULAQFM-UHFFFAOYSA-N
Compound name
N-(2,6-dimethylphenyl)-3-[2-[di(propan-2-yl)amino]ethylamino]propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

10
References

28
Patents

319.26236 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 320.269636 185.5
[M+Na]+ 342.251578 187.5
[M-H]- 318.255084 189.4
[M+NH4]+ 337.296183 199.7
[M+K]+ 358.225518 186.2
[M+H-H2O]+ 302.259620 177.1
[M+HCOO]- 364.260561 207.5
[M+CH3COO]- 378.276211 225.2
[M+Na-2H]- 340.237026 183.1
[M]+ 319.26181142 187.4
[M]- 319.26290858 187.4
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.