CID 3060972

78406-78-7

Structural Information

Molecular Formula
C19H33N3O2
SMILES
CCN(CC)CC(C(=O)NC1=C(C=C(C=C1)OC)C)N(CC)CC
InChI
InChI=1S/C19H33N3O2/c1-7-21(8-2)14-18(22(9-3)10-4)19(23)20-17-12-11-16(24-6)13-15(17)5/h11-13,18H,7-10,14H2,1-6H3,(H,20,23)
InChIKey
OWHOKOIENJOGPI-UHFFFAOYSA-N
Compound name
2,3-bis(diethylamino)-N-(4-methoxy-2-methylphenyl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

335.25726 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 336.26454 188.3
[M+Na]+ 358.24648 190.6
[M-H]- 334.24998 193.6
[M+NH4]+ 353.29108 202.5
[M+K]+ 374.22042 190.7
[M+H-H2O]+ 318.25452 179.4
[M+HCOO]- 380.25546 212.0
[M+CH3COO]- 394.27111 229.7
[M+Na-2H]- 356.23193 186.5
[M]+ 335.25671 193.6
[M]- 335.25781 193.6
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.