CID 3062540

Fc 409

Structural Information

Molecular Formula
C18H26N2O3
SMILES
CCC(=O)N(C1=C(C=CC=C1C)C)C(C)C(=O)N2CCOCC2
InChI
InChI=1S/C18H26N2O3/c1-5-16(21)20(17-13(2)7-6-8-14(17)3)15(4)18(22)19-9-11-23-12-10-19/h6-8,15H,5,9-12H2,1-4H3
InChIKey
VCURHBJPKCKPQO-UHFFFAOYSA-N
Compound name
N-(2,6-dimethylphenyl)-N-(1-morpholin-4-yl-1-oxopropan-2-yl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

318.19434 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.20162 178.6
[M+Na]+ 341.18356 181.4
[M-H]- 317.18706 184.8
[M+NH4]+ 336.22816 190.2
[M+K]+ 357.15750 181.4
[M+H-H2O]+ 301.19160 169.5
[M+HCOO]- 363.19254 194.7
[M+CH3COO]- 377.20819 214.4
[M+Na-2H]- 339.16901 177.2
[M]+ 318.19379 178.2
[M]- 318.19489 178.2
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.