CID 3060136

C 2060

Structural Information

Molecular Formula
C18H30N2O2
SMILES
CCN(CC)CC(=O)N(C)CCOC1=C(C=C(C=C1C)C)C
InChI
InChI=1S/C18H30N2O2/c1-7-20(8-2)13-17(21)19(6)9-10-22-18-15(4)11-14(3)12-16(18)5/h11-12H,7-10,13H2,1-6H3
InChIKey
MDAYQXRMJDJTIO-UHFFFAOYSA-N
Compound name
2-(diethylamino)-N-methyl-N-[2-(2,4,6-trimethylphenoxy)ethyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

306.23074 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.238016 178.2
[M+Na]+ 329.219958 183.2
[M-H]- 305.223464 184.2
[M+NH4]+ 324.264563 194.5
[M+K]+ 345.193898 182.9
[M+H-H2O]+ 289.228000 170.3
[M+HCOO]- 351.228941 202.4
[M+CH3COO]- 365.244591 222.1
[M+Na-2H]- 327.205406 177.3
[M]+ 306.23019142 185.1
[M]- 306.23128858 185.1
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.