CID 3039789

Brn 2882949

Structural Information

Molecular Formula
C19H29N3O
SMILES
CC1=C(C(=CC=C1)C)NC(=O)C(CN(C)CC=C)N(C)CC=C
InChI
InChI=1S/C19H29N3O/c1-7-12-21(5)14-17(22(6)13-8-2)19(23)20-18-15(3)10-9-11-16(18)4/h7-11,17H,1-2,12-14H2,3-6H3,(H,20,23)
InChIKey
UFASHKQOHOLXIE-UHFFFAOYSA-N
Compound name
N-(2,6-dimethylphenyl)-2,3-bis[methyl(prop-2-enyl)amino]propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

315.23105 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 316.23833 182.2
[M+Na]+ 338.22027 185.3
[M-H]- 314.22377 187.6
[M+NH4]+ 333.26487 197.2
[M+K]+ 354.19421 183.6
[M+H-H2O]+ 298.22831 173.7
[M+HCOO]- 360.22925 206.2
[M+CH3COO]- 374.24490 226.0
[M+Na-2H]- 336.20572 180.5
[M]+ 315.23050 184.7
[M]- 315.23160 184.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.