CID 56558

Brn 2817044

Structural Information

Molecular Formula
C16H24N2O3
SMILES
CCCCOC1=CC=CC=C1N(CC(=O)N(C)C)C(=O)C
InChI
InChI=1S/C16H24N2O3/c1-5-6-11-21-15-10-8-7-9-14(15)18(13(2)19)12-16(20)17(3)4/h7-10H,5-6,11-12H2,1-4H3
InChIKey
FJULPDQUPFBURM-UHFFFAOYSA-N
Compound name
2-(N-acetyl-2-butoxyanilino)-N,N-dimethylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

292.17868 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.18596 172.0
[M+Na]+ 315.16790 175.9
[M-H]- 291.17140 177.7
[M+NH4]+ 310.21250 188.0
[M+K]+ 331.14184 176.5
[M+H-H2O]+ 275.17594 163.8
[M+HCOO]- 337.17688 196.3
[M+CH3COO]- 351.19253 215.1
[M+Na-2H]- 313.15335 172.4
[M]+ 292.17813 177.3
[M]- 292.17923 177.3
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.