CID 3067800

Cm 40272

Structural Information

Molecular Formula
C17H34N2O2
SMILES
CCCCN(CCCC)C(=O)CCCNC(=O)C(C)(C)C
InChI
InChI=1S/C17H34N2O2/c1-6-8-13-19(14-9-7-2)15(20)11-10-12-18-16(21)17(3,4)5/h6-14H2,1-5H3,(H,18,21)
InChIKey
MRMGWMCHDAWRHI-UHFFFAOYSA-N
Compound name
N-[4-(dibutylamino)-4-oxobutyl]-2,2-dimethylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

298.26202 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.26930 181.1
[M+Na]+ 321.25124 183.0
[M-H]- 297.25474 181.4
[M+NH4]+ 316.29584 196.7
[M+K]+ 337.22518 182.5
[M+H-H2O]+ 281.25928 174.4
[M+HCOO]- 343.26022 201.3
[M+CH3COO]- 357.27587 215.7
[M+Na-2H]- 319.23669 180.4
[M]+ 298.26147 185.7
[M]- 298.26257 185.7
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.