CID 3039785

51246-58-3

Structural Information

Molecular Formula
C15H25N3O
SMILES
CC1=C(C(=CC=C1)C)NC(=O)C(CN(C)C)N(C)C
InChI
InChI=1S/C15H25N3O/c1-11-8-7-9-12(2)14(11)16-15(19)13(18(5)6)10-17(3)4/h7-9,13H,10H2,1-6H3,(H,16,19)
InChIKey
VXVXUZOWOOAAEE-UHFFFAOYSA-N
Compound name
2,3-bis(dimethylamino)-N-(2,6-dimethylphenyl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

263.19977 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.20705 166.7
[M+Na]+ 286.18899 170.9
[M-H]- 262.19249 172.9
[M+NH4]+ 281.23359 184.0
[M+K]+ 302.16293 171.4
[M+H-H2O]+ 246.19703 158.9
[M+HCOO]- 308.19797 191.7
[M+CH3COO]- 322.21362 215.8
[M+Na-2H]- 284.17444 167.0
[M]+ 263.19922 169.2
[M]- 263.20032 169.2
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.