CID 53936

77966-71-3

Structural Information

Molecular Formula
C15H24N2O
SMILES
CCN(CC)CC(=O)N(CC)C1=CC=CC=C1C
InChI
InChI=1S/C15H24N2O/c1-5-16(6-2)12-15(18)17(7-3)14-11-9-8-10-13(14)4/h8-11H,5-7,12H2,1-4H3
InChIKey
BCSRTTAGHQIWFT-UHFFFAOYSA-N
Compound name
2-(diethylamino)-N-ethyl-N-(2-methylphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

248.18886 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.19614 162.4
[M+Na]+ 271.17808 166.9
[M-H]- 247.18158 168.2
[M+NH4]+ 266.22268 180.5
[M+K]+ 287.15202 166.7
[M+H-H2O]+ 231.18612 154.7
[M+HCOO]- 293.18706 187.5
[M+CH3COO]- 307.20271 208.7
[M+Na-2H]- 269.16353 164.4
[M]+ 248.18831 165.9
[M]- 248.18941 165.9
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.