CID 53948

77966-79-1

Structural Information

Molecular Formula
C18H30N2O
SMILES
CCCCN(CCCC)CC(=O)NC1=C(C=CC=C1C)C
InChI
InChI=1S/C18H30N2O/c1-5-7-12-20(13-8-6-2)14-17(21)19-18-15(3)10-9-11-16(18)4/h9-11H,5-8,12-14H2,1-4H3,(H,19,21)
InChIKey
CRQDEWJMTAANQD-UHFFFAOYSA-N
Compound name
2-(dibutylamino)-N-(2,6-dimethylphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

290.2358 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.243076 175.9
[M+Na]+ 313.225018 179.8
[M-H]- 289.228524 179.9
[M+NH4]+ 308.269623 191.9
[M+K]+ 329.198958 177.4
[M+H-H2O]+ 273.233060 167.9
[M+HCOO]- 335.234001 199.3
[M+CH3COO]- 349.249651 215.4
[M+Na-2H]- 311.210466 176.3
[M]+ 290.23525142 179.5
[M]- 290.23634858 179.5
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.